N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide

Systemtic Name: N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide Openeye Name: N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide CAS Name: N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide IUPAC Name: N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide Traditional Name: N,N-dimethyl-2-(2-methyl-8-nitro-3,4-dihydro-1H-isoquinolin-5-yl)benzenesulfonamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C=CC(=C2C1)[N+](=O)[O-])C3=CC=CC=C3S(=O)(=O)N(C)C

Isomeric SMILES

CN1CCC2=C(C=CC(=C2C1)[N+](=O)[O-])C3=CC=CC=C3S(=O)(=O)N(C)C

InChI

InChI=1S/C18H21N3O4S/c1-19(2)26(24,25)18-7-5-4-6-15(18)13-8-9-17(21(22)23)16-12-20(3)11-10-14(13)16/h4-9H,10-12H2,1-3H3