[4-(cyanomethyl)phenyl] 3-bromanylbenzoate

Systemtic Name: [4-(cyanomethyl)phenyl] 3-bromanylbenzoate Openeye Name: [4-(cyanomethyl)phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-(cyanomethyl)phenyl] ester Formula: C15H10BrNO2 MolecularWeight: 316.1494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)CC#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)OC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C15H10BrNO2/c16-13-3-1-2-12(10-13)15(18)19-14-6-4-11(5-7-14)8-9-17/h1-7,10H,8H2