1-(3,3-dimethyl-5-piperidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-methyl-piperazin-4-ium

Systemtic Name: 1-(3,3-dimethyl-5-piperidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-methyl-piperazin-4-ium Openeye Name: 1-(3,3-dimethyl-5-piperidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-methyl-piperazin-4-ium CAS Name: 1-[3,3-dimethyl-5-(1-piperidin-1-iumyl)-1-cyclohexa-1,5-dienyl]-4-methylpiperazin-4-ium IUPAC Name: 1-(3,3-dimethyl-5-piperidin-1-ium-1-ylcyclohexa-1,5-dien-1-yl)-4-methylpiperazin-4-ium Traditional Name: 1-(3,3-dimethyl-5-piperidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-methyl-piperazin-4-ium Formula: C18H33N3+2 MolecularWeight: 291.47472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=C1)N2CC[NH+](CC2)C)[NH+]3CCCCC3)C

Isomeric SMILES

CC1(CC(=CC(=C1)N2CC[NH+](CC2)C)[NH+]3CCCCC3)C

InChI

InChI=1S/C18H31N3/c1-18(2)14-16(20-7-5-4-6-8-20)13-17(15-18)21-11-9-19(3)10-12-21/h13,15H,4-12,14H2,1-3H3/p+2