[(1S)-1-phenylethyl] 4-bromanyl-3-(dimethylsulfamoyl)benzoate

Systemtic Name: [(1S)-1-phenylethyl] 4-bromanyl-3-(dimethylsulfamoyl)benzoate Openeye Name: [(1S)-1-phenylethyl] 4-bromo-3-(dimethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid [(1S)-1-phenylethyl] ester IUPAC Name: [(1S)-1-phenylethyl] 4-bromo-3-(dimethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(dimethylsulfamoyl)benzoic acid [(1S)-1-phenylethyl] ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)N(C)C

InChI

InChI=1S/C17H18BrNO4S/c1-12(13-7-5-4-6-8-13)23-17(20)14-9-10-15(18)16(11-14)24(21,22)19(2)3/h4-12H,1-3H3/t12-/m0/s1