3-methyl-4-(3-pyridin-3-ylpropanoylamino)benzoic acid

Systemtic Name: 3-methyl-4-(3-pyridin-3-ylpropanoylamino)benzoic acid Openeye Name: 3-methyl-4-[3-(3-pyridyl)propanoylamino]benzoic acid CAS Name: 3-methyl-4-[[1-oxo-3-(3-pyridinyl)propyl]amino]benzoic acid IUPAC Name: 3-methyl-4-(3-pyridin-3-ylpropanoylamino)benzoic acid Traditional Name: 3-methyl-4-[3-(3-pyridyl)propanoylamino]benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCC2=CN=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CCC2=CN=CC=C2

InChI

InChI=1S/C16H16N2O3/c1-11-9-13(16(20)21)5-6-14(11)18-15(19)7-4-12-3-2-8-17-10-12/h2-3,5-6,8-10H,4,7H2,1H3,(H,18,19)(H,20,21)