[(3R)-9,9-dimethyl-6-(phenylsulfonyl)-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide

Systemtic Name: [(3R)-9,9-dimethyl-6-(phenylsulfonyl)-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide Openeye Name: [(3R)-6-(benzenesulfonyl)-9,9-dimethyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide CAS Name: [(3R)-6-(benzenesulfonyl)-9,9-dimethyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide IUPAC Name: [(3R)-6-(benzenesulfonyl)-9,9-dimethyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide Traditional Name: [(3R)-6-besyl-9,9-dimethyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]azanide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=C(CC(CC2)[NH-])C3=C1C=CC(=C3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

C[N+]1(C2=C(C[C@@H](CC2)[NH-])C3=C1C=CC(=C3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H22N2O2S/c1-22(2)19-10-8-14(21)12-17(19)18-13-16(9-11-20(18)22)25(23,24)15-6-4-3-5-7-15/h3-7,9,11,13-14,21H,8,10,12H2,1-2H3/t14-/m1/s1