ethyl 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)-1-oxoprop-2-enyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(E)-2-cyano-3-(7-ethyl-1H-indol-3-yl)acryloyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C=C(C#N)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2/C=C(\C#N)/C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C23H23N3O3/c1-5-15-8-7-9-18-17(12-25-21(15)18)10-16(11-24)22(27)20-13(3)19(14(4)26-20)23(28)29-6-2/h7-10,12,25-26H,5-6H2,1-4H3/b16-10+