methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[[(2S)-2-oxidanyl-4-phenyl-butanoyl]-propyl-amino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[[(2S)-2-oxidanyl-4-phenyl-butanoyl]-propyl-amino]pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-[[(2S)-2-hydroxy-4-phenyl-butanoyl]-propyl-amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-[[(2S)-2-hydroxy-1-oxo-4-phenylbutyl]-propylamino]-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-[[(2S)-2-hydroxy-4-phenylbutanoyl]-propylamino]-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-[[(2S)-2-hydroxy-4-phenyl-butanoyl]-propyl-amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C26H34N2O7S MolecularWeight: 518.62236

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)C(=O)C(CCC3=CC=CC=C3)O

Isomeric SMILES

CCCN([C@H]1C[C@@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)C(=O)[C@H](CCC3=CC=CC=C3)O

InChI

InChI=1S/C26H34N2O7S/c1-4-16-27(25(30)24(29)15-10-19-8-6-5-7-9-19)20-17-23(26(31)35-3)28(18-20)36(32,33)22-13-11-21(34-2)12-14-22/h5-9,11-14,20,23-24,29H,4,10,15-18H2,1-3H3/t20-,23+,24-/m0/s1