cyclohexylmethyl-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclohexylmethyl-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclohexylmethyl-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]ammonium CAS Name: cyclohexylmethyl-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]ammonium IUPAC Name: cyclohexylmethyl-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]azanium Traditional Name: cyclohexylmethyl-[2-keto-2-(4-tosylpiperazino)ethyl]ammonium Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH2+]CC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[NH2+]CC3CCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-17-7-9-19(10-8-17)27(25,26)23-13-11-22(12-14-23)20(24)16-21-15-18-5-3-2-4-6-18/h7-10,18,21H,2-6,11-16H2,1H3/p+1