N-cyclopropyl-2-[4-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[1-(4-ethoxyphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[1-(4-ethoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[1-(4-ethoxyphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(1-p-phenetylsulfonylisonipecotoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H35N4O5S+ MolecularWeight: 479.6128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C23H34N4O5S/c1-2-32-20-5-7-21(8-6-20)33(30,31)27-11-9-18(10-12-27)23(29)26-15-13-25(14-16-26)17-22(28)24-19-3-4-19/h5-8,18-19H,2-4,9-17H2,1H3,(H,24,28)/p+1