Chemical ID: 7529686

c1ccc(c(c1)NC(=O)COc2cccc(c2)C(=O)O)Cl
Chemical ID:
7529686
Name [?]:
3-[(2-chlorophenyl)carbamoylmethoxy]benzoic acid
SMILES [?]:
c1ccc(c(c1)NC(=O)COc2cccc(c2)C(=O)O)Cl
InChi [?]:
InChI=1/C15H12ClNO4/c16-12-6-1-2-7-13(12)17-14(18)9-21-11-5-3-4-10(8-11)15(19)20/h1-8H,9H2,(H,17,18)(H,19,20)
InChi Info:
AuxInfo=1/1/N:2,1,14,15,13,3,6,17,10,16,12,4,5,8,18,21,7,9,19,20,11/E:(19,20)/rA:21nCCCCCCNCOCOCCCCCCCOOCl/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;s12;d13;s14;d15;d12s16;s16;d18;s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12ClNO4
All Atoms:33
Heavy Atoms:21
Chiral Atoms:None
ZAP Information [?]
Total:8.04511
Area:505.607
Solvation:-4.59507
Coulombic:-56.541
Bond Count [?]
All:22
Single:14
Double:8
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.91
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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