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

Systemtic Name: 1-(furan-2-yl)-3-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 1-(2-furyl)-3-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile CAS Name: 1-(2-furanyl)-3-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 1-(furan-2-yl)-3-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 1-(2-furyl)-3-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]-2-pyrindan-2-ium-4-carbonitrile Formula: C23H29N5O2+2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C3=[NH+]C(=C4CCCC4=C3C#N)C5=CC=CO5

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C3=[NH+]C(=C4CCCC4=C3C#N)C5=CC=CO5

InChI

InChI=1S/C23H27N5O2/c24-15-19-17-5-3-6-18(17)22(20-7-4-14-30-20)25-23(19)28-12-10-26(11-13-28)16-21(29)27-8-1-2-9-27/h4,7,14H,1-3,5-6,8-13,16H2/p+2