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

Systemtic Name: ethyl 4-[(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(E)-2-cyano-3-[1-(2-cyanoethyl)-3-indolyl]-1-oxoprop-2-enyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]prop-2-enoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[(E)-2-cyano-3-[1-(2-cyanoethyl)indol-3-yl]acryloyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C(=CC2=CN(C3=CC=CC=C32)CCC#N)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)/C(=C/C2=CN(C3=CC=CC=C32)CCC#N)/C#N)C)C

InChI

InChI=1S/C24H22N4O3/c1-4-31-24(30)22-16(3)27-15(2)21(22)23(29)17(13-26)12-18-14-28(11-7-10-25)20-9-6-5-8-19(18)20/h5-6,8-9,12,14,27H,4,7,11H2,1-3H3/b17-12+