4-methyl-3-[[4-[(propanoylamino)methyl]phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-methyl-3-[[4-[(propanoylamino)methyl]phenyl]carbonylamino]benzoic acid Openeye Name: 4-methyl-3-[[4-[(propanoylamino)methyl]benzoyl]amino]benzoic acid CAS Name: 4-methyl-3-[[oxo-[4-[(1-oxopropylamino)methyl]phenyl]methyl]amino]benzoic acid IUPAC Name: 4-methyl-3-[[4-[(propanoylamino)methyl]benzoyl]amino]benzoic acid Traditional Name: 4-methyl-3-[[4-(propionamidomethyl)benzoyl]amino]benzoic acid Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCC(=O)NCC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C19H20N2O4/c1-3-17(22)20-11-13-5-8-14(9-6-13)18(23)21-16-10-15(19(24)25)7-4-12(16)2/h4-10H,3,11H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)