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2-[3-[(4-carboxyphenyl)methyl]pentanoylamino]benzoic acid

2-[3-[(4-carboxyphenyl)methyl]pentanoylamino]benzoic acid

Systemtic Name:2-[3-[(4-carboxyphenyl)methyl]pentanoylamino]benzoic acid
Openeye Name:2-[3-[(4-carboxyphenyl)methyl]pentanoylamino]benzoic acid
CAS Name:2-[[3-[(4-carboxyphenyl)methyl]-1-oxopentyl]amino]benzoic acid
IUPAC Name:2-[3-[(4-carboxyphenyl)methyl]pentanoylamino]benzoic acid
Traditional Name:2-[3-(4-carboxybenzyl)pentanoylamino]benzoic acid
Formula: C20H21NO5
MolecularWeight: 355.38444
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)C(=O)O)CC(=O)NC2=CC=CC=C2C(=O)O


Isomeric SMILES

CCC(CC1=CC=C(C=C1)C(=O)O)CC(=O)NC2=CC=CC=C2C(=O)O


InChI

InChI=1S/C20H21NO5/c1-2-13(11-14-7-9-15(10-8-14)19(23)24)12-18(22)21-17-6-4-3-5-16(17)20(25)26/h3-10,13H,2,11-12H2,1H3,(H,21,22)(H,23,24)(H,25,26)


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