methyl (4Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-(pyridin-3-ylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-2-methyl-5-oxidanylidene-1-(pyridin-3-ylmethyl)pyrrole-3-carboxylate Openeye Name: methyl (4Z)-4-[(4-hydroxy-3-methoxy-phenyl)methylene]-2-methyl-5-oxo-1-(3-pyridylmethyl)pyrrole-3-carboxylate CAS Name: (4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-1-(3-pyridinylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-1-(pyridin-3-ylmethyl)pyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-2-methyl-1-(3-pyridylmethyl)-4-vanillylidene-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC(=C(C=C2)O)OC)C(=O)N1CC3=CN=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC(=C(C=C2)O)OC)/C(=O)N1CC3=CN=CC=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O5/c1-13-19(21(26)28-3)16(9-14-6-7-17(24)18(10-14)27-2)20(25)23(13)12-15-5-4-8-22-11-15/h4-11,24H,12H2,1-3H3/b16-9-