2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-(1-methyl-5-p-toluoyl-pyrrol-2-yl)acetonitrile Formula: C15H14N2O MolecularWeight: 238.28446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC#N

InChI

InChI=1S/C15H14N2O/c1-11-3-5-12(6-4-11)15(18)14-8-7-13(9-10-16)17(14)2/h3-8H,9H2,1-2H3