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

Systemtic Name: N-(1-cyclopropylcarbonyl-3,4-dihydro-2H-quinolin-7-yl)-3-nitro-benzenesulfonamide Openeye Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzenesulfonamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-nitro-benzenesulfonamide Formula: C19H19N3O5S MolecularWeight: 401.43626

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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)C(=O)C4CC4

Isomeric SMILES

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])N(C1)C(=O)C4CC4

InChI

InChI=1S/C19H19N3O5S/c23-19(14-6-7-14)21-10-2-3-13-8-9-15(11-18(13)21)20-28(26,27)17-5-1-4-16(12-17)22(24)25/h1,4-5,8-9,11-12,14,20H,2-3,6-7,10H2