(4R)-1-(3-chlorophenyl)sulfonyl-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2-carboxylic acid

Systemtic Name: (4R)-1-(3-chlorophenyl)sulfonyl-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2-carboxylic acid Openeye Name: (4R)-4-(tert-butoxycarbonylamino)-1-(3-chlorophenyl)sulfonyl-2-methyl-pyrrolidine-2-carboxylic acid CAS Name: (4R)-1-(3-chlorophenyl)sulfonyl-2-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrrolidinecarboxylic acid IUPAC Name: (4R)-1-(3-chlorophenyl)sulfonyl-2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2-carboxylic acid Traditional Name: (4R)-4-(tert-butoxycarbonylamino)-1-(3-chlorophenyl)sulfonyl-2-methyl-proline Formula: C17H23ClN2O6S MolecularWeight: 418.89232

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CN1S(=O)(=O)C2=CC(=CC=C2)Cl)NC(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1(C[C@H](CN1S(=O)(=O)C2=CC(=CC=C2)Cl)NC(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C17H23ClN2O6S/c1-16(2,3)26-15(23)19-12-9-17(4,14(21)22)20(10-12)27(24,25)13-7-5-6-11(18)8-13/h5-8,12H,9-10H2,1-4H3,(H,19,23)(H,21,22)/t12-,17?/m1/s1