Chemical ID: 7528736

Cc1cccc(c1OC)C(=O)Nc2ccccc2C(=O)O
Chemical ID:
7528736
Name [?]:
2-(2-methoxy-3-methyl-benzoyl)aminobenzoic acid
SMILES [?]:
Cc1cccc(c1OC)C(=O)Nc2ccccc2C(=O)O
InChi [?]:
InChI=1/C16H15NO4/c1-10-6-5-8-12(14(10)21-2)15(18)17-13-9-4-3-7-11(13)16(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,9,16,15,4,3,17,5,14,2,18,6,13,7,10,19,12,11,20,21,8/E:(19,20)/rA:21nCCCCCCCOCCONCCCCCCCOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s6;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;d19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15NO4
All Atoms:36
Heavy Atoms:21
Chiral Atoms:None
ZAP Information [?]
Total:7.96995
Area:460.217
Solvation:-3.53548
Coulombic:-57.2006
Bond Count [?]
All:22
Single:14
Double:8
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.39
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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