2-[5-(4-bromophenyl)carbonyl-4-chloranyl-1-propyl-pyrrol-2-yl]ethanenitrile

Systemtic Name: 2-[5-(4-bromophenyl)carbonyl-4-chloranyl-1-propyl-pyrrol-2-yl]ethanenitrile Openeye Name: 2-[5-(4-bromobenzoyl)-4-chloro-1-propyl-pyrrol-2-yl]acetonitrile CAS Name: 2-[5-[(4-bromophenyl)-oxomethyl]-4-chloro-1-propyl-2-pyrrolyl]acetonitrile IUPAC Name: 2-[5-(4-bromobenzoyl)-4-chloro-1-propylpyrrol-2-yl]acetonitrile Traditional Name: 2-[5-(4-bromobenzoyl)-4-chloro-1-propyl-pyrrol-2-yl]acetonitrile Formula: C16H14BrClN2O MolecularWeight: 365.65216

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C(=O)C2=CC=C(C=C2)Br)Cl)CC#N

Isomeric SMILES

CCCN1C(=CC(=C1C(=O)C2=CC=C(C=C2)Br)Cl)CC#N

InChI

InChI=1S/C16H14BrClN2O/c1-2-9-20-13(7-8-19)10-14(18)15(20)16(21)11-3-5-12(17)6-4-11/h3-6,10H,2,7,9H2,1H3