Chemical ID: 7691625

CCOC(=O)C1CCCN(C1)C(=O)C(=O)c2c[nH]c3c2cccc3
Chemical ID:
7691625
Name [?]:
None
SMILES [?]:
CCOC(=O)C1CCCN(C1)C(=O)C(=O)c2c[nH]c3c2cccc3
InChi [?]:
InChI=1/C18H20N2O4/c1-2-24-18(23)12-6-5-9-20(11-12)17(22)16(21)14-10-19-15-8-4-3-7-13(14)15/h3-4,7-8,10,12,19H,2,5-6,9,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,22,23,8,7,21,24,9,17,11,6,20,16,19,14,12,4,18,10,15,13,5,3/rA:24cCCOCOCCCCNCCOCOCCNCCCCCC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s6s10;s10;d12;s12;d14;s14;d16;s17;s18;s16s19;d20;s21;d22;d19s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20N2O4
All Atoms:44
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:10.6248
Area:534.623
Solvation:-2.7408
Coulombic:-58.2259
Bond Count [?]
All:26
Single:19
Double:7
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.91
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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