[2-[(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(1-ethylpiperidin-1-ium-4-yl)-methyl-azanium

Systemtic Name: [2-[(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(1-ethylpiperidin-1-ium-4-yl)-methyl-azanium Openeye Name: [2-[2-ethoxy-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-(1-ethylpiperidin-1-ium-4-yl)-methyl-ammonium CAS Name: [2-[2-ethoxy-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-(1-ethyl-4-piperidin-1-iumyl)-methylammonium IUPAC Name: [2-(2-ethoxy-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-(1-ethylpiperidin-1-ium-4-yl)-methylazanium Traditional Name: [2-(2-ethoxy-5-piperidinosulfonyl-anilino)-2-keto-ethyl]-(1-ethylpiperidin-1-ium-4-yl)-methyl-ammonium Formula: C23H40N4O4S+2 MolecularWeight: 468.6531

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N4O4S/c1-4-26-15-11-19(12-16-26)25(3)18-23(28)24-21-17-20(9-10-22(21)31-5-2)32(29,30)27-13-7-6-8-14-27/h9-10,17,19H,4-8,11-16,18H2,1-3H3,(H,24,28)/p+2