ethyl 4-[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(E)-2-cyano-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)acryloyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C(=CC2=CC(=C(C(=C2)OC)OC)OC)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)/C(=C/C2=CC(=C(C(=C2)OC)OC)OC)/C#N)C)C

InChI

InChI=1S/C22H24N2O6/c1-7-30-22(26)19-13(3)24-12(2)18(19)20(25)15(11-23)8-14-9-16(27-4)21(29-6)17(10-14)28-5/h8-10,24H,7H2,1-6H3/b15-8+