(4-ethylpiperazin-4-ium-1-yl)-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[(3R)-1-(p-tolylsulfonyl)-3-piperidyl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[(3R)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[(3R)-1-tosyl-3-piperidyl]methanone Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H29N3O3S/c1-3-20-11-13-21(14-12-20)19(23)17-5-4-10-22(15-17)26(24,25)18-8-6-16(2)7-9-18/h6-9,17H,3-5,10-15H2,1-2H3/p+1/t17-/m1/s1