2-[4-[(2,3-dimethyl-4-oxidanylidene-pyridin-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(2,3-dimethyl-4-oxidanylidene-pyridin-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(2,3-dimethyl-4-oxo-1-pyridyl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(2,3-dimethyl-4-oxo-1-pyridinyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(2,3-dimethyl-4-oxopyridin-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(4-keto-2,3-dimethyl-1-pyridyl)methyl]phenyl]benzoic acid Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=CC1=O)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1=C(N(C=CC1=O)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C

InChI

InChI=1S/C21H19NO3/c1-14-15(2)22(12-11-20(14)23)13-16-7-9-17(10-8-16)18-5-3-4-6-19(18)21(24)25/h3-12H,13H2,1-2H3,(H,24,25)