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

Systemtic Name: 2-[4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-ium-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-[4-cyano-1-(2-furyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-ium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-[4-cyano-1-(2-furanyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]-1-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[4-[4-cyano-1-(furan-2-yl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]piperazin-1-ium-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-[4-cyano-1-(2-furyl)-2-pyrindan-3-yl]piperazin-1-ium-1-yl]-N-phenethyl-acetamide Formula: C27H30N5O2+ MolecularWeight: 456.5594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NC(=C2C1)C3=CC=CO3)N4CC[NH+](CC4)CC(=O)NCCC5=CC=CC=C5)C#N

Isomeric SMILES

C1CC2=C(C(=NC(=C2C1)C3=CC=CO3)N4CC[NH+](CC4)CC(=O)NCCC5=CC=CC=C5)C#N

InChI

InChI=1S/C27H29N5O2/c28-18-23-21-8-4-9-22(21)26(24-10-5-17-34-24)30-27(23)32-15-13-31(14-16-32)19-25(33)29-12-11-20-6-2-1-3-7-20/h1-3,5-7,10,17H,4,8-9,11-16,19H2,(H,29,33)/p+1