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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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