2-(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)carbonyl-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: 2-(1-cyclopentyl-2,5-dimethyl-pyrrol-3-yl)carbonyl-3-phenylazanyl-prop-2-enenitrile Openeye Name: 3-anilino-2-(1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbonyl)prop-2-enenitrile CAS Name: 3-anilino-2-[(1-cyclopentyl-2,5-dimethyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: 3-anilino-2-(1-cyclopentyl-2,5-dimethylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: 3-anilino-2-(1-cyclopentyl-2,5-dimethyl-pyrrole-3-carbonyl)acrylonitrile Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCC2)C)C(=O)C(=CNC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1C2CCCC2)C)C(=O)C(=CNC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H23N3O/c1-15-12-20(16(2)24(15)19-10-6-7-11-19)21(25)17(13-22)14-23-18-8-4-3-5-9-18/h3-5,8-9,12,14,19,23H,6-7,10-11H2,1-2H3