3-methyl-2-(3-pyridin-3-ylpropanoylamino)benzoic acid

Systemtic Name: 3-methyl-2-(3-pyridin-3-ylpropanoylamino)benzoic acid Openeye Name: 3-methyl-2-[3-(3-pyridyl)propanoylamino]benzoic acid CAS Name: 3-methyl-2-[[1-oxo-3-(3-pyridinyl)propyl]amino]benzoic acid IUPAC Name: 3-methyl-2-(3-pyridin-3-ylpropanoylamino)benzoic acid Traditional Name: 3-methyl-2-[3-(3-pyridyl)propanoylamino]benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)CCC2=CN=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)CCC2=CN=CC=C2)C(=O)O

InChI

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