(2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: (2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-hydroxy-pyrrolidine-2-carboxamide CAS Name: (2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-hydroxy-2-pyrrolidinecarboxamide IUPAC Name: (2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-hydroxypyrrolidine-2-carboxamide Traditional Name: (2S,3S)-N-[4-(hexylsulfonylmethyl)phenyl]-3-hydroxy-pyrrolidine-2-carboxamide Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)CC1=CC=C(C=C1)NC(=O)C2C(CCN2)O

Isomeric SMILES

CCCCCCS(=O)(=O)CC1=CC=C(C=C1)NC(=O)[C@@H]2[C@H](CCN2)O

InChI

InChI=1S/C18H28N2O4S/c1-2-3-4-5-12-25(23,24)13-14-6-8-15(9-7-14)20-18(22)17-16(21)10-11-19-17/h6-9,16-17,19,21H,2-5,10-13H2,1H3,(H,20,22)/t16-,17-/m0/s1