(4S,4aR,9aS)-4a-ethanoyl-4-methoxy-9-(4-methylphenyl)sulfonyl-1,3,4,9a-tetrahydrocarbazol-2-one

Systemtic Name: (4S,4aR,9aS)-4a-ethanoyl-4-methoxy-9-(4-methylphenyl)sulfonyl-1,3,4,9a-tetrahydrocarbazol-2-one Openeye Name: (4S,4aR,9aS)-4a-acetyl-4-methoxy-9-(p-tolylsulfonyl)-1,3,4,9a-tetrahydrocarbazol-2-one CAS Name: (4S,4aR,9aS)-4a-acetyl-4-methoxy-9-(4-methylphenyl)sulfonyl-1,3,4,9a-tetrahydrocarbazol-2-one IUPAC Name: (4S,4aR,9aS)-4a-acetyl-4-methoxy-9-(4-methylphenyl)sulfonyl-1,3,4,9a-tetrahydrocarbazol-2-one Traditional Name: (4S,4aR,9aS)-4a-acetyl-4-methoxy-9-tosyl-1,3,4,9a-tetrahydrocarbazol-2-one Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3CC(=O)CC(C3(C4=CC=CC=C42)C(=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H]3CC(=O)C[C@@H]([C@]3(C4=CC=CC=C42)C(=O)C)OC

InChI

InChI=1S/C22H23NO5S/c1-14-8-10-17(11-9-14)29(26,27)23-19-7-5-4-6-18(19)22(15(2)24)20(23)12-16(25)13-21(22)28-3/h4-11,20-21H,12-13H2,1-3H3/t20-,21-,22-/m0/s1