N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butyl]-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxidanylidene-butyl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxo-butyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[4-(3,4-dihydro-2H-quinolin-1-yl)-4-keto-butyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC(=O)N1CCCC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-21(29(27,28)18-12-10-17(11-13-18)23(25)26)14-5-9-20(24)22-15-4-7-16-6-2-3-8-19(16)22/h2-3,6,8,10-13H,4-5,7,9,14-15H2,1H3