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

Systemtic Name: 6,7-dimethoxy-1-methyl-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-1-methyl-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-1-methyl-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-1-methyl-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-1-methyl-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H20N2O6S/c1-12-16-11-18(26-3)17(25-2)9-13(16)7-8-19(12)27(23,24)15-6-4-5-14(10-15)20(21)22/h4-6,9-12H,7-8H2,1-3H3