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

Systemtic Name: 2-[4-[(2-methyl-4-oxidanylidene-3-phenylmethoxy-pyridin-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(3-benzyloxy-2-methyl-4-oxo-1-pyridyl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(2-methyl-4-oxo-3-phenylmethoxy-1-pyridinyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(2-methyl-4-oxo-3-phenylmethoxypyridin-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(3-benzoxy-4-keto-2-methyl-1-pyridyl)methyl]phenyl]benzoic acid Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C=CN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23NO4/c1-19-26(32-18-21-7-3-2-4-8-21)25(29)15-16-28(19)17-20-11-13-22(14-12-20)23-9-5-6-10-24(23)27(30)31/h2-16H,17-18H2,1H3,(H,30,31)