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

Systemtic Name: methyl (4Z)-2-methyl-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]-1-prop-2-enyl-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-allyl-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylene]pyrrole-3-carboxylate CAS Name: (4Z)-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]-1-prop-2-enyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]-1-prop-2-enylpyrrole-3-carboxylate Traditional Name: (4Z)-1-allyl-5-keto-2-methyl-4-(3-phenoxybenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C23H21NO4 MolecularWeight: 375.41714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)N1CC=C)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC(=CC=C2)OC3=CC=CC=C3)/C(=O)N1CC=C)C(=O)OC

InChI

InChI=1S/C23H21NO4/c1-4-13-24-16(2)21(23(26)27-3)20(22(24)25)15-17-9-8-12-19(14-17)28-18-10-6-5-7-11-18/h4-12,14-15H,1,13H2,2-3H3/b20-15-