methyl (2R,4S)-4-(methylsulfonylamino)-1-(4-pyridin-4-yloxyphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-(methylsulfonylamino)-1-(4-pyridin-4-yloxyphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-(methanesulfonamido)-1-[4-(4-pyridyloxy)phenyl]sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-(methanesulfonamido)-1-(4-pyridin-4-yloxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-(methanesulfonamido)-1-(4-pyridin-4-yloxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-(methanesulfonamido)-1-[4-(4-pyridyloxy)phenyl]sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)NS(=O)(=O)C

Isomeric SMILES

COC(=O)[C@H]1C[C@@H](CN1S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)NS(=O)(=O)C

InChI

InChI=1S/C18H21N3O7S2/c1-27-18(22)17-11-13(20-29(2,23)24)12-21(17)30(25,26)16-5-3-14(4-6-16)28-15-7-9-19-10-8-15/h3-10,13,17,20H,11-12H2,1-2H3/t13-,17+/m0/s1