6,7-dimethoxy-1-(2-nitrophenyl)-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-1-(2-nitrophenyl)-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzenesulfonyl)-6,7-dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-besyl-6,7-dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isoquinoline Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-])OC

InChI

InChI=1S/C23H22N2O6S/c1-30-21-14-16-12-13-24(32(28,29)17-8-4-3-5-9-17)23(19(16)15-22(21)31-2)18-10-6-7-11-20(18)25(26)27/h3-11,14-15,23H,12-13H2,1-2H3