(3S)-3-(phenylsulfonylamino)-3-(4-propan-2-ylphenyl)propanoic acid

Systemtic Name: (3S)-3-(phenylsulfonylamino)-3-(4-propan-2-ylphenyl)propanoic acid Openeye Name: (3S)-3-(benzenesulfonamido)-3-(4-isopropylphenyl)propanoic acid CAS Name: (3S)-3-(benzenesulfonamido)-3-(4-propan-2-ylphenyl)propanoic acid IUPAC Name: (3S)-3-(benzenesulfonamido)-3-(4-propan-2-ylphenyl)propanoic acid Traditional Name: (3S)-3-(benzenesulfonamido)-3-p-cumenyl-propionic acid Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@H](CC(=O)O)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21NO4S/c1-13(2)14-8-10-15(11-9-14)17(12-18(20)21)19-24(22,23)16-6-4-3-5-7-16/h3-11,13,17,19H,12H2,1-2H3,(H,20,21)/t17-/m0/s1