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

Systemtic Name: methyl 2-methyl-4-[(3-methylphenyl)methylidene]-5-oxidanylidene-1-propyl-pyrrole-3-carboxylate Openeye Name: methyl 2-methyl-4-(m-tolylmethylene)-5-oxo-1-propyl-pyrrole-3-carboxylate CAS Name: 2-methyl-4-[(3-methylphenyl)methylidene]-5-oxo-1-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-4-[(3-methylphenyl)methylidene]-5-oxo-1-propylpyrrole-3-carboxylate Traditional Name: 5-keto-2-methyl-4-(3-methylbenzylidene)-1-propyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=CC2=CC(=CC=C2)C)C1=O)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(=CC2=CC(=CC=C2)C)C1=O)C(=O)OC)C

InChI

InChI=1S/C18H21NO3/c1-5-9-19-13(3)16(18(21)22-4)15(17(19)20)11-14-8-6-7-12(2)10-14/h6-8,10-11H,5,9H2,1-4H3