N-cyclopropyl-2-[4-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[(3S)-1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(3S)-1-(4-methoxyphenyl)sulfonylnipecotoyl]piperazin-1-ium-1-yl]acetamide Formula: C22H33N4O5S+ MolecularWeight: 465.58622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C22H32N4O5S/c1-31-19-6-8-20(9-7-19)32(29,30)26-10-2-3-17(15-26)22(28)25-13-11-24(12-14-25)16-21(27)23-18-4-5-18/h6-9,17-18H,2-5,10-16H2,1H3,(H,23,27)/p+1/t17-/m0/s1