N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(1-pyrrolidinyl)ethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-ylethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidino-ethyl]-2-nitro-benzenesulfonamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C1C=CC(=C2)C(CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])N4CCCC4

Isomeric SMILES

CN1CCCC2=C1C=CC(=C2)C(CNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C22H28N4O4S/c1-24-12-6-7-17-15-18(10-11-19(17)24)21(25-13-4-5-14-25)16-23-31(29,30)22-9-3-2-8-20(22)26(27)28/h2-3,8-11,15,21,23H,4-7,12-14,16H2,1H3