N-[(2R)-3-methylbutan-2-yl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2R)-3-methylbutan-2-yl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1,2-dimethylpropyl]-2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2R)-3-methylbutan-2-yl]-2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2R)-3-methylbutan-2-yl]-2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1,2-dimethylpropyl]-2-(4-tosylpiperazin-1-ium-1-yl)acetamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N[C@H](C)C(C)C

InChI

InChI=1S/C18H29N3O3S/c1-14(2)16(4)19-18(22)13-20-9-11-21(12-10-20)25(23,24)17-7-5-15(3)6-8-17/h5-8,14,16H,9-13H2,1-4H3,(H,19,22)/p+1/t16-/m1/s1