[2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]azanium

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]azanium Openeye Name: [2-(diethylamino)-2-oxo-ethyl]-methyl-[2-oxo-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]ammonium CAS Name: [2-(diethylamino)-2-oxoethyl]-methyl-[2-oxo-2-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethyl]ammonium IUPAC Name: [2-(diethylamino)-2-oxoethyl]-methyl-[2-oxo-2-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]azanium Traditional Name: [2-(diethylamino)-2-keto-ethyl]-[2-keto-2-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]-methyl-ammonium Formula: C22H35N4O4S+ MolecularWeight: 451.6027

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+](C)CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC)C(=O)C[NH+](C)CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H34N4O4S/c1-4-24(5-2)21(27)16-23(3)17-22(28)26-14-8-9-18-15-19(10-11-20(18)26)31(29,30)25-12-6-7-13-25/h10-11,15H,4-9,12-14,16-17H2,1-3H3/p+1