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

Systemtic Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethylamino]-N-methyl-3-nitro-benzenesulfonamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCCN2CCCC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCCN2CCCC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-19-27(25,26)15-8-9-16(18(13-15)22(23)24)20-10-12-21-11-4-6-14-5-2-3-7-17(14)21/h2-3,5,7-9,13,19-20H,4,6,10-12H2,1H3