1-[(4-ethylphenyl)methyl]-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium

Systemtic Name: 1-[(4-ethylphenyl)methyl]-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium Openeye Name: 1-[(4-ethylphenyl)methyl]-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium CAS Name: 1-[(4-ethylphenyl)methyl]-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium Traditional Name: 1-(4-ethylbenzyl)-4-[(1R,2S)-2-methylcyclohexyl]piperazine-1,4-diium Formula: C20H34N2+2 MolecularWeight: 302.49736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C3CCCCC3C

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)[C@@H]3CCCC[C@@H]3C

InChI

InChI=1S/C20H32N2/c1-3-18-8-10-19(11-9-18)16-21-12-14-22(15-13-21)20-7-5-4-6-17(20)2/h8-11,17,20H,3-7,12-16H2,1-2H3/p+2/t17-,20+/m0/s1