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

Systemtic Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-(1-pyrrolidinyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidin-1-ylethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-2-pyrrolidino-ethyl]-4-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=C(C=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O4S/c1-24-12-4-5-17-15-18(6-11-21(17)24)22(25-13-2-3-14-25)16-23-31(29,30)20-9-7-19(8-10-20)26(27)28/h6-11,15,22-23H,2-5,12-14,16H2,1H3