1-[1-[(1R,3R)-3-methylcyclohexyl]piperidin-1-ium-4-yl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[1-[(1R,3R)-3-methylcyclohexyl]piperidin-1-ium-4-yl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[1-[(1R,3R)-3-methylcyclohexyl]piperidin-1-ium-4-yl]-4-phenyl-piperazin-1-ium CAS Name: 1-[1-[(1R,3R)-3-methylcyclohexyl]-4-piperidin-1-iumyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[1-[(1R,3R)-3-methylcyclohexyl]piperidin-1-ium-4-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[1-[(1R,3R)-3-methylcyclohexyl]piperidin-1-ium-4-yl]-4-phenyl-piperazin-1-ium Formula: C22H37N3+2 MolecularWeight: 343.54928

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH+]2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CCC[C@H](C1)[NH+]2CCC(CC2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H35N3/c1-19-6-5-9-22(18-19)23-12-10-21(11-13-23)25-16-14-24(15-17-25)20-7-3-2-4-8-20/h2-4,7-8,19,21-22H,5-6,9-18H2,1H3/p+2/t19-,22-/m1/s1