3-nitro-N-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]benzenesulfonamide

Systemtic Name: 3-nitro-N-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]benzenesulfonamide Openeye Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzenesulfonamide CAS Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzenesulfonamide Traditional Name: N-(1-besyl-3,4-dihydro-2H-quinolin-7-yl)-3-nitro-benzenesulfonamide Formula: C21H19N3O6S2 MolecularWeight: 473.52206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N(C1)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N(C1)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O6S2/c25-24(26)18-7-4-10-20(15-18)31(27,28)22-17-12-11-16-6-5-13-23(21(16)14-17)32(29,30)19-8-2-1-3-9-19/h1-4,7-12,14-15,22H,5-6,13H2