2-[1-butyl-5-(2,4-dichlorophenyl)carbonyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[1-butyl-5-(2,4-dichlorophenyl)carbonyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[1-butyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]acetonitrile CAS Name: 2-[1-butyl-5-[(2,4-dichlorophenyl)-oxomethyl]-2-pyrrolyl]acetonitrile IUPAC Name: 2-[1-butyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]acetonitrile Traditional Name: 2-[1-butyl-5-(2,4-dichlorobenzoyl)pyrrol-2-yl]acetonitrile Formula: C17H16Cl2N2O MolecularWeight: 335.22774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)CC#N

Isomeric SMILES

CCCCN1C(=CC=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)CC#N

InChI

InChI=1S/C17H16Cl2N2O/c1-2-3-10-21-13(8-9-20)5-7-16(21)17(22)14-6-4-12(18)11-15(14)19/h4-7,11H,2-3,8,10H2,1H3