1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium CAS Name: 1-[[(1R)-1-cyclohex-3-enyl]methyl]-4-[[4-(methylthio)phenyl]methyl]piperazine-1,4-diium IUPAC Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[4-(methylthio)benzyl]piperazine-1,4-diium Formula: C19H30N2S+2 MolecularWeight: 318.5199

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C[C@@H]3CCC=CC3

InChI

InChI=1S/C19H28N2S/c1-22-19-9-7-18(8-10-19)16-21-13-11-20(12-14-21)15-17-5-3-2-4-6-17/h2-3,7-10,17H,4-6,11-16H2,1H3/p+2/t17-/m0/s1