1-cyclohexyl-4-(2-methoxyphenyl)-1-(3-pyridin-2-ylbutyl)piperazin-1-ium

Systemtic Name: 1-cyclohexyl-4-(2-methoxyphenyl)-1-(3-pyridin-2-ylbutyl)piperazin-1-ium Openeye Name: 1-cyclohexyl-4-(2-methoxyphenyl)-1-[3-(2-pyridyl)butyl]piperazin-1-ium CAS Name: 1-cyclohexyl-4-(2-methoxyphenyl)-1-[3-(2-pyridinyl)butyl]piperazin-1-ium IUPAC Name: 1-cyclohexyl-4-(2-methoxyphenyl)-1-(3-pyridin-2-ylbutyl)piperazin-1-ium Traditional Name: 1-cyclohexyl-4-(2-methoxyphenyl)-1-[3-(2-pyridyl)butyl]piperazin-1-ium Formula: C26H38N3O+ MolecularWeight: 408.59942

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[N+]1(CCN(CC1)C2=CC=CC=C2OC)C3CCCCC3)C4=CC=CC=N4

Isomeric SMILES

CC(CC[N+]1(CCN(CC1)C2=CC=CC=C2OC)C3CCCCC3)C4=CC=CC=N4

InChI

InChI=1S/C26H38N3O/c1-22(24-12-8-9-16-27-24)15-19-29(23-10-4-3-5-11-23)20-17-28(18-21-29)25-13-6-7-14-26(25)30-2/h6-9,12-14,16,22-23H,3-5,10-11,15,17-21H2,1-2H3/q+1