1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(2-methylphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(2-methylphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(o-tolylmethyl)piperazine-1,4-diium CAS Name: 1-[[(1R)-1-cyclohex-3-enyl]methyl]-4-[(2-methylphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-[(2-methylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-[[(1R)-cyclohex-3-en-1-yl]methyl]-4-(2-methylbenzyl)piperazine-1,4-diium Formula: C19H30N2+2 MolecularWeight: 286.4549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC3CCC=CC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)C[C@@H]3CCC=CC3

InChI

InChI=1S/C19H28N2/c1-17-7-5-6-10-19(17)16-21-13-11-20(12-14-21)15-18-8-3-2-4-9-18/h2-3,5-7,10,18H,4,8-9,11-16H2,1H3/p+2/t18-/m0/s1