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

Systemtic Name: 3-[4-(2-piperidin-1-ium-1-ylethanoyl)piperazin-1-yl]-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 1-isopropyl-3-[4-(2-piperidin-1-ium-1-ylacetyl)piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile CAS Name: 3-[4-[1-oxo-2-(1-piperidin-1-iumyl)ethyl]-1-piperazinyl]-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 3-[4-(2-piperidin-1-ium-1-ylacetyl)piperazin-1-yl]-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 1-isopropyl-3-[4-(2-piperidin-1-ium-1-ylacetyl)piperazino]-2-pyrindan-2-ium-4-carbonitrile Formula: C23H35N5O+2 MolecularWeight: 397.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C[NH+]4CCCCC4)C#N

Isomeric SMILES

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C[NH+]4CCCCC4)C#N

InChI

InChI=1S/C23H33N5O/c1-17(2)22-19-8-6-7-18(19)20(15-24)23(25-22)28-13-11-27(12-14-28)21(29)16-26-9-4-3-5-10-26/h17H,3-14,16H2,1-2H3/p+2