3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile CAS Name: 3-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-2-[oxo(1-piperidinyl)methyl]-2-propenenitrile IUPAC Name: 3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-(piperidine-1-carbonyl)acrylonitrile Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)N3CCCCC3)C

InChI

InChI=1S/C22H25N3O/c1-16-7-9-21(10-8-16)25-17(2)13-19(18(25)3)14-20(15-23)22(26)24-11-5-4-6-12-24/h7-10,13-14H,4-6,11-12H2,1-3H3