4-[2-[(6-methylpyridin-3-yl)carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(6-methylpyridin-3-yl)carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(6-methylpyridine-3-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[(6-methyl-3-pyridinyl)-oxomethyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(6-methylpyridine-3-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(6-methylnicotinoyl)amino]ethyl]benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

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