Chemical ID: 7655833

Cc1c(c(n(n1)CCC(=O)NC(C)CN(C(C)C)C(C)C)C)[N+](=O)[O-]
Chemical ID:
7655833
Name [?]:
None
SMILES [?]:
Cc1c(c(n(n1)CCC(=O)NC(C)CN(C(C)C)C(C)C)C)[N+](=O)[O-]
InChi [?]:
InChI=1/C17H31N5O3/c1-11(2)20(12(3)4)10-13(5)18-16(23)8-9-21-15(7)17(22(24)25)14(6)19-21/h11-13H,8-10H2,1-7H3,(H,18,23)
InChi Info:
AuxInfo=1/1/N:17,18,20,21,13,1,22,8,7,14,16,19,12,2,4,9,3,11,6,15,5,23,10,24,25/E:(1,2,3,4)(11,12)(24,25)/CRV:22.5/rA:25cCCCCNNCCCONCCCNCCCCCCCN+OO-/rB:s1;s2;d3;s4;d2s5;s5;s7;s8;d9;s9;s11;s12;s12;s14;s15;s16;s16;s15;s19;s19;s4;s3;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H31N5O3
All Atoms:56
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:7.75055
Area:604.489
Solvation:-7.36167
Coulombic:-42.6459
Bond Count [?]
All:25
Single:21
Double:4
Rotors:10
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.48
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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