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Chemical ID: 7708433

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc(cc3)[N+](=O)[O-]

Chemical ID:

7708433

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc(cc3)[N+](=O)[O-]

InChi [?]:

InChI=1/C24H23N3O5/c1-17-3-5-20(6-4-17)16-31-22-11-7-19(8-12-22)15-25-26-24(28)18(2)32-23-13-9-21(10-14-23)27(29)30/h3-15,18H,16H2,1-2H3,(H,26,28)

InChi Info:

AuxInfo=1/1/N:1,22,3,7,4,6,12,14,26,28,11,15,25,29,16,8,2,21,13,5,27,10,24,19,17,18,30,20,31,32,9,23/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(29,30)/CRV:27.5/rA:32cCCCCCCCCOCCCCCCCNNCOCCOCCCCCCN+OO-/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;w16;s17;s18;d19;s19;s21;s21;s23;s24;d25;s26;d27;d24s28;s27;d30;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₃N₃O₅
All Atoms:	55
Heavy Atoms:	32
Chiral Atoms:	None

ZAP Information [?]

Total:	4.97101
Area:	697.819
Solvation:	-12.4745
Coulombic:	-45.7023

Bond Count [?]

All:	34
Single:	22
Double:	12
Rotors:	10
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	6.03
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value