Chemical ID: 6709253

COc1ccc(cc1)C(=O)Nc2ccccc2C(=O)[O-]
Chemical ID:
6709253
Name [?]:
2-(4-methoxybenzoyl)aminobenzoate
SMILES [?]:
COc1ccc(cc1)C(=O)Nc2ccccc2C(=O)[O-]
InChi [?]:
InChI=1/C15H13NO4/c1-20-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)/p-1
InChi Info:
AuxInfo=1/1/N:1,15,14,16,13,5,7,4,8,6,3,17,12,9,18,11,10,19,20,2/E:(6,7)(8,9)(18,19)/rA:20nCOCCCCCCCONCCCCCCCOO-/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12NO4-
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:-31.24
Area:452.628
Solvation:-42.5557
Coulombic:-31.3388
Bond Count [?]
All:21
Single:13
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:270.26
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.69
LogP (Chemaxon):3.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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