[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[methyl(phenylsulfonyl)amino]-3-phenyl-butanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[methyl(phenylsulfonyl)amino]-3-phenyl-butanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-[benzenesulfonyl(methyl)amino]-3-phenyl-butanoate CAS Name: 4-[benzenesulfonyl(methyl)amino]-3-phenylbutanoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-[benzenesulfonyl(methyl)amino]-3-phenylbutanoate Traditional Name: 4-[besyl(methyl)amino]-3-phenyl-butyric acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C25H24BrNO5S MolecularWeight: 530.43076

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CC(=O)OCC(=O)C1=CC=C(C=C1)Br)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(CC(=O)OCC(=O)C1=CC=C(C=C1)Br)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H24BrNO5S/c1-27(33(30,31)23-10-6-3-7-11-23)17-21(19-8-4-2-5-9-19)16-25(29)32-18-24(28)20-12-14-22(26)15-13-20/h2-15,21H,16-18H2,1H3