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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CC#N)N)C(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)CC#N)N)C(=O)C2=C(C=C(C=C2)Br)Cl

InChI

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