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

Systemtic Name: ethyl 4-[(E)-2-cyano-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(E)-2-cyano-3-[5-(3-nitrophenyl)-2-thienyl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(E)-2-cyano-3-[5-(3-nitrophenyl)-2-thiophenyl]-1-oxoprop-2-enyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-cyano-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[(E)-2-cyano-3-[5-(3-nitrophenyl)-2-thienyl]acryloyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C(=CC2=CC=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)/C(=C/C2=CC=C(S2)C3=CC(=CC=C3)[N+](=O)[O-])/C#N)C)C

InChI

InChI=1S/C23H19N3O5S/c1-4-31-23(28)21-14(3)25-13(2)20(21)22(27)16(12-24)11-18-8-9-19(32-18)15-6-5-7-17(10-15)26(29)30/h5-11,25H,4H2,1-3H3/b16-11+