[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 4-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 4-bromanylbenzoate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C22H18BrNO3 MolecularWeight: 424.28722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H18BrNO3/c23-19-12-10-17(11-13-19)22(26)27-15-21(25)24-20-9-5-4-8-18(20)14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H,24,25)