4-methyl-N-[(2S)-6-methyl-5-oxidanyl-4-(phenylsulfonyl)heptan-2-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(2S)-6-methyl-5-oxidanyl-4-(phenylsulfonyl)heptan-2-yl]benzenesulfonamide Openeye Name: N-[(1S)-3-(benzenesulfonyl)-4-hydroxy-1,5-dimethyl-hexyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-4-(benzenesulfonyl)-5-hydroxy-6-methylheptan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-4-(benzenesulfonyl)-5-hydroxy-6-methylheptan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S)-3-besyl-4-hydroxy-1,5-dimethyl-hexyl]-4-methyl-benzenesulfonamide Formula: C21H29NO5S2 MolecularWeight: 439.58866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)CC(C(C(C)C)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)CC(C(C(C)C)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H29NO5S2/c1-15(2)21(23)20(28(24,25)18-8-6-5-7-9-18)14-17(4)22-29(26,27)19-12-10-16(3)11-13-19/h5-13,15,17,20-23H,14H2,1-4H3/t17-,20?,21?/m0/s1