2-[(2S,3S)-3,5-dimethyl-1-oxidanyl-2-[1-(phenylsulfonyl)pyrrol-2-yl]cyclopentyl]pentan-3-one

Systemtic Name: 2-[(2S,3S)-3,5-dimethyl-1-oxidanyl-2-[1-(phenylsulfonyl)pyrrol-2-yl]cyclopentyl]pentan-3-one Openeye Name: 2-[(2S,3S)-2-[1-(benzenesulfonyl)pyrrol-2-yl]-1-hydroxy-3,5-dimethyl-cyclopentyl]pentan-3-one CAS Name: 2-[(2S,3S)-2-[1-(benzenesulfonyl)-2-pyrrolyl]-1-hydroxy-3,5-dimethylcyclopentyl]-3-pentanone IUPAC Name: 2-[(2S,3S)-2-[1-(benzenesulfonyl)pyrrol-2-yl]-1-hydroxy-3,5-dimethylcyclopentyl]pentan-3-one Traditional Name: 2-[(2S,3S)-2-(1-besylpyrrol-2-yl)-1-hydroxy-3,5-dimethyl-cyclopentyl]pentan-3-one Formula: C22H29NO4S MolecularWeight: 403.53496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)C1(C(CC(C1C2=CC=CN2S(=O)(=O)C3=CC=CC=C3)C)C)O

Isomeric SMILES

CCC(=O)C(C)C1([C@@H]([C@H](CC1C)C)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H29NO4S/c1-5-20(24)17(4)22(25)16(3)14-15(2)21(22)19-12-9-13-23(19)28(26,27)18-10-7-6-8-11-18/h6-13,15-17,21,25H,5,14H2,1-4H3/t15-,16?,17?,21-,22?/m0/s1