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

Systemtic Name: 6,7-dimethoxy-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-(3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C17H18N2O6S MolecularWeight: 378.39962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18N2O6S/c1-24-16-8-12-6-7-18(11-13(12)9-17(16)25-2)26(22,23)15-5-3-4-14(10-15)19(20)21/h3-5,8-10H,6-7,11H2,1-2H3