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

Systemtic Name: 1-propan-2-yl-3-[4-(2-pyrrolidin-1-ium-1-ylethanoyl)piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 1-isopropyl-3-[4-(2-pyrrolidin-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-pyrrolidin-1-iumyl)ethyl]-1-piperazinyl]-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 1-propan-2-yl-3-[4-(2-pyrrolidin-1-ium-1-ylacetyl)piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 1-isopropyl-3-[4-(2-pyrrolidin-1-ium-1-ylacetyl)piperazino]-2-pyrindan-2-ium-4-carbonitrile Formula: C22H33N5O+2 MolecularWeight: 383.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C[NH+]4CCCC4)C#N

Isomeric SMILES

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)C[NH+]4CCCC4)C#N

InChI

InChI=1S/C22H31N5O/c1-16(2)21-18-7-5-6-17(18)19(14-23)22(24-21)27-12-10-26(11-13-27)20(28)15-25-8-3-4-9-25/h16H,3-13,15H2,1-2H3/p+2