2-[5-(3-chloranyl-4-methyl-phenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(3-chloranyl-4-methyl-phenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[5-(3-chloro-4-methyl-benzoyl)-1-methyl-pyrrol-2-yl]acetonitrile CAS Name: 2-[5-[(3-chloro-4-methylphenyl)-oxomethyl]-1-methyl-2-pyrrolyl]acetonitrile IUPAC Name: 2-[5-(3-chloro-4-methylbenzoyl)-1-methylpyrrol-2-yl]acetonitrile Traditional Name: 2-[5-(3-chloro-4-methyl-benzoyl)-1-methyl-pyrrol-2-yl]acetonitrile Formula: C15H13ClN2O MolecularWeight: 272.72952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClN2O/c1-10-3-4-11(9-13(10)16)15(19)14-6-5-12(7-8-17)18(14)2/h3-6,9H,7H2,1-2H3