methyl (2R,4S)-4-azanyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-azanyl-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-amino-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-amino-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-amino-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-amino-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O5S/c1-19-10-3-5-11(6-4-10)21(17,18)15-8-9(14)7-12(15)13(16)20-2/h3-6,9,12H,7-8,14H2,1-2H3/t9-,12+/m0/s1