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

Systemtic Name: 2-[4-(4-cyano-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-ium-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[4-(4-cyano-1-isopropyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-ium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[4-(4-cyano-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)-1-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[4-(4-cyano-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-ium-1-yl]-N-phenethylacetamide Traditional Name: 2-[4-(4-cyano-1-isopropyl-2-pyrindan-2-ium-3-yl)piperazin-1-ium-1-yl]-N-phenethyl-acetamide Formula: C26H35N5O+2 MolecularWeight: 433.589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCCC4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCCC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H33N5O/c1-19(2)25-22-10-6-9-21(22)23(17-27)26(29-25)31-15-13-30(14-16-31)18-24(32)28-12-11-20-7-4-3-5-8-20/h3-5,7-8,19H,6,9-16,18H2,1-2H3,(H,28,32)/p+2