dimethyl-[2-[[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl]azanium Openeye Name: dimethyl-[2-[[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]ammonio]ethyl]ammonium CAS Name: dimethyl-[2-[[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]ammonio]ethyl]ammonium IUPAC Name: dimethyl-[2-[[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]azaniumyl]ethyl]azanium Traditional Name: 2-[[2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]ammonio]ethyl-dimethyl-ammonium Formula: C18H32N4O3S+2 MolecularWeight: 384.53668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH2+]CC[NH+](C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH2+]CC[NH+](C)C

InChI

InChI=1S/C18H30N4O3S/c1-15-7-8-16(26(24,25)22-10-5-4-6-11-22)13-17(15)20-18(23)14-19-9-12-21(2)3/h7-8,13,19H,4-6,9-12,14H2,1-3H3,(H,20,23)/p+2