3-(3-bromophenyl)-4-cyano-4-phenyl-butanoic acid

Systemtic Name: 3-(3-bromophenyl)-4-cyano-4-phenyl-butanoic acid Openeye Name: 3-(3-bromophenyl)-4-cyano-4-phenyl-butanoic acid CAS Name: 3-(3-bromophenyl)-4-cyano-4-phenylbutanoic acid IUPAC Name: 3-(3-bromophenyl)-4-cyano-4-phenylbutanoic acid Traditional Name: 3-(3-bromophenyl)-4-cyano-4-phenyl-butyric acid Formula: C17H14BrNO2 MolecularWeight: 344.20256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14BrNO2/c18-14-8-4-7-13(9-14)15(10-17(20)21)16(11-19)12-5-2-1-3-6-12/h1-9,15-16H,10H2,(H,20,21)