[2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: [2-(diethylamino)-2-oxo-ethyl]-methyl-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]ammonium CAS Name: [2-(diethylamino)-2-oxoethyl]-methyl-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: [2-(diethylamino)-2-oxoethyl]-methyl-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: [2-(diethylamino)-2-keto-ethyl]-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]-methyl-ammonium Formula: C19H31N4O4S+ MolecularWeight: 411.53884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+](C)CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCN(CC)C(=O)C[NH+](C)CC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C19H30N4O4S/c1-4-22(5-2)19(25)15-21(3)14-18(24)20-16-9-8-10-17(13-16)28(26,27)23-11-6-7-12-23/h8-10,13H,4-7,11-12,14-15H2,1-3H3,(H,20,24)/p+1