1-(4-methylcyclohexyl)-4-(phenylmethyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(4-methylcyclohexyl)-4-(phenylmethyl)sulfonyl-piperazin-1-ium Openeye Name: 1-benzylsulfonyl-4-(4-methylcyclohexyl)piperazin-4-ium CAS Name: 1-(4-methylcyclohexyl)-4-(phenylmethyl)sulfonylpiperazin-1-ium IUPAC Name: 1-benzylsulfonyl-4-(4-methylcyclohexyl)piperazin-4-ium Traditional Name: 1-benzylsulfonyl-4-(4-methylcyclohexyl)piperazin-4-ium Formula: C18H29N2O2S+ MolecularWeight: 337.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H28N2O2S/c1-16-7-9-18(10-8-16)19-11-13-20(14-12-19)23(21,22)15-17-5-3-2-4-6-17/h2-6,16,18H,7-15H2,1H3/p+1