2-[4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl]piperazin-1-ium-1-yl]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl]piperazin-1-ium-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[4-[4-cyano-1-(2-furyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl]piperazin-1-ium-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-[4-cyano-1-(2-furanyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl]-1-piperazin-1-iumyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl]piperazin-1-ium-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-[4-cyano-1-(2-furyl)-2-pyrindan-2-ium-3-yl]piperazin-1-ium-1-yl]-N-methyl-N-phenyl-acetamide Formula: C26H29N5O2+2 MolecularWeight: 443.54076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N5O2/c1-29(19-7-3-2-4-8-19)24(32)18-30-12-14-31(15-13-30)26-22(17-27)20-9-5-10-21(20)25(28-26)23-11-6-16-33-23/h2-4,6-8,11,16H,5,9-10,12-15,18H2,1H3/p+2