methyl (4Z)-2-methyl-5-oxidanylidene-4-(phenylmethylidene)-1-prop-2-enyl-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-2-methyl-5-oxidanylidene-4-(phenylmethylidene)-1-prop-2-enyl-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-allyl-4-benzylidene-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-2-methyl-5-oxo-4-(phenylmethylene)-1-prop-2-enyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-4-benzylidene-2-methyl-5-oxo-1-prop-2-enylpyrrole-3-carboxylate Traditional Name: (4Z)-1-allyl-4-benzal-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO3/c1-4-10-18-12(2)15(17(20)21-3)14(16(18)19)11-13-8-6-5-7-9-13/h4-9,11H,1,10H2,2-3H3/b14-11-