methyl-(1-methylpiperidin-1-ium-4-yl)-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]ammonium CAS Name: methyl-(1-methyl-4-piperidin-1-iumyl)-[2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: [2-keto-2-(4-piperidinosulfonylanilino)ethyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C20H34N4O3S+2 MolecularWeight: 410.57396

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H32N4O3S/c1-22-14-10-18(11-15-22)23(2)16-20(25)21-17-6-8-19(9-7-17)28(26,27)24-12-4-3-5-13-24/h6-9,18H,3-5,10-16H2,1-2H3,(H,21,25)/p+2