2-[[(4R)-4-[(3-chlorophenyl)sulfonylamino]pyrrolidin-2-yl]carbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid

Systemtic Name: 2-[[(4R)-4-[(3-chlorophenyl)sulfonylamino]pyrrolidin-2-yl]carbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid Openeye Name: 3-(4-tert-butoxyphenyl)-2-[[(4R)-4-[(3-chlorophenyl)sulfonylamino]pyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: 2-[[[(4R)-4-[(3-chlorophenyl)sulfonylamino]-2-pyrrolidinyl]-oxomethyl]amino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid IUPAC Name: 2-[[(4R)-4-[(3-chlorophenyl)sulfonylamino]pyrrolidine-2-carbonyl]amino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid Traditional Name: 3-(4-tert-butoxyphenyl)-2-[[(4R)-4-[(3-chlorophenyl)sulfonylamino]prolyl]amino]propionic acid Formula: C24H30ClN3O6S MolecularWeight: 524.0295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2CC(CN2)NS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2C[C@H](CN2)NS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H30ClN3O6S/c1-24(2,3)34-18-9-7-15(8-10-18)11-21(23(30)31)27-22(29)20-13-17(14-26-20)28-35(32,33)19-6-4-5-16(25)12-19/h4-10,12,17,20-21,26,28H,11,13-14H2,1-3H3,(H,27,29)(H,30,31)/t17-,20?,21?/m1/s1