dimethyl 4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 1-benzyl-4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-(phenylmethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-benzyl-4-(3-chloro-4-hydroxy-5-methoxyphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-benzyl-4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C23H22ClNO6 MolecularWeight: 443.87688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=CC=C3)C(=O)OC)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=CC=C3)C(=O)OC)Cl)O

InChI

InChI=1S/C23H22ClNO6/c1-29-19-10-15(9-18(24)21(19)26)20-16(22(27)30-2)12-25(13-17(20)23(28)31-3)11-14-7-5-4-6-8-14/h4-10,12-13,20,26H,11H2,1-3H3