(phenylmethyl) 5-[[5-(2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-[[5-(2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-[[5-(2-cyano-3-methoxy-3-oxo-prop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-[[5-(2-cyano-3-methoxy-3-oxoprop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[[5-(2-cyano-3-methoxy-3-oxoprop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-[[5-(2-cyano-3-keto-3-methoxy-prop-1-enyl)-3-ethyl-4-methyl-1H-pyrrol-2-yl]methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)C=C(C#N)C(=O)OC)CC2=C(C(=C(N2)C(=O)OCC3=CC=CC=C3)C)CC

Isomeric SMILES

CCC1=C(NC(=C1C)C=C(C#N)C(=O)OC)CC2=C(C(=C(N2)C(=O)OCC3=CC=CC=C3)C)CC

InChI

InChI=1S/C28H31N3O4/c1-6-21-17(3)23(13-20(15-29)27(32)34-5)30-24(21)14-25-22(7-2)18(4)26(31-25)28(33)35-16-19-11-9-8-10-12-19/h8-13,30-31H,6-7,14,16H2,1-5H3