methyl (2R,4S)-4-[bis(methylsulfonyl)amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-[bis(methylsulfonyl)amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-[bis(methylsulfonyl)amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-[bis(methylsulfonyl)amino]-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-[bis(methylsulfonyl)amino]-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-(dimesylamino)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C15H22N2O9S3 MolecularWeight: 470.53818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2C[C@H](C[C@@H]2C(=O)OC)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O9S3/c1-25-12-5-7-13(8-6-12)29(23,24)16-10-11(9-14(16)15(18)26-2)17(27(3,19)20)28(4,21)22/h5-8,11,14H,9-10H2,1-4H3/t11-,14+/m0/s1