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

Systemtic Name: ethyl 4-[(E)-2-cyano-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(E)-2-cyano-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(E)-2-cyano-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-cyano-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[(E)-2-cyano-3-(2-ethylbenzofuran-3-yl)acryloyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=C(C#N)C(=O)C3=C(NC(=C3C(=O)OCC)C)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C(\C#N)/C(=O)C3=C(NC(=C3C(=O)OCC)C)C

InChI

InChI=1S/C23H22N2O4/c1-5-18-17(16-9-7-8-10-19(16)29-18)11-15(12-24)22(26)20-13(3)25-14(4)21(20)23(27)28-6-2/h7-11,25H,5-6H2,1-4H3/b15-11+