2-[(2-butyl-4-methoxy-6-oxidanylidene-pyridin-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(2-butyl-4-methoxy-6-oxidanylidene-pyridin-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(2-butyl-4-methoxy-6-oxo-1-pyridyl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(2-butyl-4-methoxy-6-oxo-1-pyridinyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(2-butyl-4-methoxy-6-oxopyridin-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(2-butyl-6-keto-4-methoxy-1-pyridyl)methyl]-6-phenyl-benzoic acid Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25NO4/c1-3-4-12-19-14-20(29-2)15-22(26)25(19)16-18-11-8-13-21(23(18)24(27)28)17-9-6-5-7-10-17/h5-11,13-15H,3-4,12,16H2,1-2H3,(H,27,28)