1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium

Systemtic Name: 1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-methylcyclohexyl)piperazine-1,4-diium CAS Name: 1-(4-methylcyclohexyl)-4-[1-(phenylmethyl)-4-piperidin-1-iumyl]piperazine-1,4-diium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-methylcyclohexyl)piperazine-1,4-diium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-methylcyclohexyl)piperazine-1,4-diium Formula: C23H40N3+3 MolecularWeight: 358.5838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH+]2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1CCC(CC1)[NH+]2CC[NH+](CC2)C3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H37N3/c1-20-7-9-22(10-8-20)25-15-17-26(18-16-25)23-11-13-24(14-12-23)19-21-5-3-2-4-6-21/h2-6,20,22-23H,7-19H2,1H3/p+3