1-(4-phenylcyclohexyl)-4-(pyridin-3-ylmethyl)piperazine-1,4-diium

Systemtic Name: 1-(4-phenylcyclohexyl)-4-(pyridin-3-ylmethyl)piperazine-1,4-diium Openeye Name: 1-(4-phenylcyclohexyl)-4-(3-pyridylmethyl)piperazine-1,4-diium CAS Name: 1-(4-phenylcyclohexyl)-4-(3-pyridinylmethyl)piperazine-1,4-diium IUPAC Name: 1-(4-phenylcyclohexyl)-4-(pyridin-3-ylmethyl)piperazine-1,4-diium Traditional Name: 1-(4-phenylcyclohexyl)-4-(3-pyridylmethyl)piperazine-1,4-diium Formula: C22H31N3+2 MolecularWeight: 337.50164

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CN=CC=C4

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)[NH+]3CC[NH+](CC3)CC4=CN=CC=C4

InChI

InChI=1S/C22H29N3/c1-2-6-20(7-3-1)21-8-10-22(11-9-21)25-15-13-24(14-16-25)18-19-5-4-12-23-17-19/h1-7,12,17,21-22H,8-11,13-16,18H2/p+2