2-[(2-butyl-6-oxidanylidene-pyridin-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(2-butyl-6-oxidanylidene-pyridin-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(2-butyl-6-oxo-1-pyridyl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(2-butyl-6-oxo-1-pyridinyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(2-butyl-6-oxopyridin-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(2-butyl-6-keto-1-pyridyl)methyl]-6-phenyl-benzoic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=CC(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO3/c1-2-3-12-19-13-8-15-21(25)24(19)16-18-11-7-14-20(22(18)23(26)27)17-9-5-4-6-10-17/h4-11,13-15H,2-3,12,16H2,1H3,(H,26,27)