methyl 2-methyl-4-[(4-methylphenyl)methylidene]-5-oxidanylidene-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-4-[(4-methylphenyl)methylidene]-5-oxidanylidene-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-2-methyl-5-oxo-4-(p-tolylmethylene)pyrrole-3-carboxylate CAS Name: 2-methyl-4-[(4-methylphenyl)methylidene]-5-oxo-1-(phenylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-2-methyl-4-[(4-methylphenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: 1-benzyl-5-keto-2-methyl-4-(4-methylbenzylidene)-2-pyrroline-3-carboxylic acid methyl ester Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC3=CC=CC=C3)C)C(=O)OC

InChI

InChI=1S/C22H21NO3/c1-15-9-11-17(12-10-15)13-19-20(22(25)26-3)16(2)23(21(19)24)14-18-7-5-4-6-8-18/h4-13H,14H2,1-3H3