Chemical ID: 6733467

c1ccc(c(c1)C(=O)Nc2cccc(c2)C(=O)[O-])N
Chemical ID:
6733467
Name [?]:
3-(2-aminobenzoyl)aminobenzoate
SMILES [?]:
c1ccc(c(c1)C(=O)Nc2cccc(c2)C(=O)[O-])N
InChi [?]:
InChI=1/C14H12N2O3/c15-12-7-2-1-6-11(12)13(17)16-10-5-3-4-9(8-10)14(18)19/h1-8H,15H2,(H,16,17)(H,18,19)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,12,13,11,6,3,15,14,10,5,4,7,16,19,9,8,17,18/E:(18,19)/rA:19nCCCCCCCONCCCCCCCOO-N/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;d16;s16;s4;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11N2O3-
All Atoms:30
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-34.996
Area:437.064
Solvation:-45.9226
Coulombic:-37.2255
Bond Count [?]
All:20
Single:12
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.249
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:1.74
LogP (Chemaxon):2.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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