2-[(4-carboxyphenyl)carbonylamino]-4-(propanoylamino)benzoic acid

Systemtic Name: 2-[(4-carboxyphenyl)carbonylamino]-4-(propanoylamino)benzoic acid Openeye Name: 2-[(4-carboxybenzoyl)amino]-4-(propanoylamino)benzoic acid CAS Name: 2-[[(4-carboxyphenyl)-oxomethyl]amino]-4-(1-oxopropylamino)benzoic acid IUPAC Name: 2-[(4-carboxybenzoyl)amino]-4-(propanoylamino)benzoic acid Traditional Name: 2-[(4-carboxybenzoyl)amino]-4-propionamido-benzoic acid Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C(=O)O)NC(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H16N2O6/c1-2-15(21)19-12-7-8-13(18(25)26)14(9-12)20-16(22)10-3-5-11(6-4-10)17(23)24/h3-9H,2H2,1H3,(H,19,21)(H,20,22)(H,23,24)(H,25,26)