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

Systemtic Name: 3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]-1-propyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 3-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]-1-propyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile CAS Name: 3-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]-1-propyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 3-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]-1-propyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 3-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]-1-propyl-2-pyrindan-2-ium-4-carbonitrile Formula: C23H35N5O+2 MolecularWeight: 397.5569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N

Isomeric SMILES

CCCC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N

InChI

InChI=1S/C23H33N5O/c1-2-7-21-19-9-6-8-18(19)20(16-24)23(25-21)28-14-12-26(13-15-28)17-22(29)27-10-4-3-5-11-27/h2-15,17H2,1H3/p+2