2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-chloranyl-phenyl]ethanenitrile

Systemtic Name: 2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-chloranyl-phenyl]ethanenitrile Openeye Name: 2-[2-amino-3-(4-bromobenzoyl)-5-chloro-phenyl]acetonitrile CAS Name: 2-[2-amino-3-[(4-bromophenyl)-oxomethyl]-5-chlorophenyl]acetonitrile IUPAC Name: 2-[2-amino-3-(4-bromobenzoyl)-5-chlorophenyl]acetonitrile Traditional Name: 2-[2-amino-3-(4-bromobenzoyl)-5-chloro-phenyl]acetonitrile Formula: C15H10BrClN2O MolecularWeight: 349.6097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC(=CC(=C2N)CC#N)Cl)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC(=CC(=C2N)CC#N)Cl)Br

InChI

InChI=1S/C15H10BrClN2O/c16-11-3-1-9(2-4-11)15(20)13-8-12(17)7-10(5-6-18)14(13)19/h1-4,7-8H,5,19H2