2-(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)carbonyl-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile

Systemtic Name: 2-(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)carbonyl-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile Openeye Name: 2-(1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbonyl)-4-(1,3,3-trimethylindolin-2-ylidene)but-2-enenitrile CAS Name: 2-[(1-cyclopentyl-2,5-dimethyl-3-pyrrolyl)-oxomethyl]-4-(1,3,3-trimethyl-2-indolylidene)-2-butenenitrile IUPAC Name: 2-(1-cyclopentyl-2,5-dimethylpyrrole-3-carbonyl)-4-(1,3,3-trimethylindol-2-ylidene)but-2-enenitrile Traditional Name: 2-(1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbonyl)-4-(1,3,3-trimethylindolin-2-ylidene)but-2-enenitrile Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCC2)C)C(=O)C(=CC=C3C(C4=CC=CC=C4N3C)(C)C)C#N

Isomeric SMILES

CC1=CC(=C(N1C2CCCC2)C)C(=O)C(=CC=C3C(C4=CC=CC=C4N3C)(C)C)C#N

InChI

InChI=1S/C27H31N3O/c1-18-16-22(19(2)30(18)21-10-6-7-11-21)26(31)20(17-28)14-15-25-27(3,4)23-12-8-9-13-24(23)29(25)5/h8-9,12-16,21H,6-7,10-11H2,1-5H3