8,9-dimethoxy-6-(3-methylsulfonylphenyl)-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol

Systemtic Name: 8,9-dimethoxy-6-(3-methylsulfonylphenyl)-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol Openeye Name: 8,9-dimethoxy-6-(3-methylsulfonylphenyl)-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol CAS Name: 8,9-dimethoxy-6-(3-methylsulfonylphenyl)-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol IUPAC Name: 8,9-dimethoxy-6-(3-methylsulfonylphenyl)-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol Traditional Name: 6-(3-mesylphenyl)-8,9-dimethoxy-1,2,3,4,4a,10b-hexahydrophenanthridin-2-ol Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC(=CC=C4)S(=O)(=O)C)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3CC(CCC3N=C2C4=CC(=CC=C4)S(=O)(=O)C)O)OC

InChI

InChI=1S/C22H25NO5S/c1-27-20-11-16-17-10-14(24)7-8-19(17)23-22(18(16)12-21(20)28-2)13-5-4-6-15(9-13)29(3,25)26/h4-6,9,11-12,14,17,19,24H,7-8,10H2,1-3H3