cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-dimethyl-ammonium CAS Name: cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-dimethylammonium IUPAC Name: cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-dimethylazanium Traditional Name: cyclopentyl-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]-dimethyl-ammonium Formula: C21H34N3O3S+ MolecularWeight: 408.57796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[N+](C)(C)C3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[N+](C)(C)C3CCCC3)C

InChI

InChI=1S/C21H34N3O3S/c1-17-9-10-20(18(2)15-17)28(26,27)23-13-11-22(12-14-23)21(25)16-24(3,4)19-7-5-6-8-19/h9-10,15,19H,5-8,11-14,16H2,1-4H3/q+1