N-(4-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[4-(1-piperidylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methoxyphenyl)-2-[4-(1-piperidinylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-(4-piperidin-1-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(4-methoxyphenyl)-2-(4-piperidinosulfonylpiperazin-1-ium-1-yl)acetamide Formula: C18H29N4O4S+ MolecularWeight: 397.51226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H28N4O4S/c1-26-17-7-5-16(6-8-17)19-18(23)15-20-11-13-22(14-12-20)27(24,25)21-9-3-2-4-10-21/h5-8H,2-4,9-15H2,1H3,(H,19,23)/p+1