1-(2-methylpropyl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile

Systemtic Name: 1-(2-methylpropyl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 1-isobutyl-3-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile CAS Name: 1-(2-methylpropyl)-3-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 1-(2-methylpropyl)-3-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 1-isobutyl-3-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]-2-pyrindan-2-ium-4-carbonitrile Formula: C24H37N5O+2 MolecularWeight: 411.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N

Isomeric SMILES

CC(C)CC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N

InChI

InChI=1S/C24H35N5O/c1-18(2)15-22-20-8-6-7-19(20)21(16-25)24(26-22)29-13-11-27(12-14-29)17-23(30)28-9-4-3-5-10-28/h18H,3-15,17H2,1-2H3/p+2