methyl (3S)-3-(4-bromophenyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: methyl (3S)-3-(4-bromophenyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: methyl (3S)-3-[(4-acetylphenyl)sulfonylamino]-3-(4-bromophenyl)propanoate CAS Name: (3S)-3-[(4-acetylphenyl)sulfonylamino]-3-(4-bromophenyl)propanoic acid methyl ester IUPAC Name: methyl (3S)-3-[(4-acetylphenyl)sulfonylamino]-3-(4-bromophenyl)propanoate Traditional Name: (3S)-3-[(4-acetylphenyl)sulfonylamino]-3-(4-bromophenyl)propionic acid methyl ester Formula: C18H18BrNO5S MolecularWeight: 440.30822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO5S/c1-12(21)13-5-9-16(10-6-13)26(23,24)20-17(11-18(22)25-2)14-3-7-15(19)8-4-14/h3-10,17,20H,11H2,1-2H3/t17-/m0/s1