methyl-[(4-methylphenyl)methyl]-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: methyl-[(4-methylphenyl)methyl]-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-(p-tolylmethyl)ammonium CAS Name: methyl-[(4-methylphenyl)methyl]-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]ammonium IUPAC Name: methyl-[(4-methylphenyl)methyl]-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(4-mesylpiperazino)ethyl]-methyl-(4-methylbenzyl)ammonium Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C16H25N3O3S/c1-14-4-6-15(7-5-14)12-17(2)13-16(20)18-8-10-19(11-9-18)23(3,21)22/h4-7H,8-13H2,1-3H3/p+1