methyl (4Z)-1,2-dimethyl-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-1,2-dimethyl-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1,2-dimethyl-5-oxo-4-[(3-phenoxyphenyl)methylene]pyrrole-3-carboxylate CAS Name: (4Z)-1,2-dimethyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1,2-dimethyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Traditional Name: (4Z)-5-keto-1,2-dimethyl-4-(3-phenoxybenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)N1C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC(=CC=C2)OC3=CC=CC=C3)/C(=O)N1C)C(=O)OC

InChI

InChI=1S/C21H19NO4/c1-14-19(21(24)25-3)18(20(23)22(14)2)13-15-8-7-11-17(12-15)26-16-9-5-4-6-10-16/h4-13H,1-3H3/b18-13-