2-[4-(4-cyano-1-propyl-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-propyl-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-propyl-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-propyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)-1-piperazin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[4-(4-cyano-1-propyl-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-propyl-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:

CCCC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCCC4=CC=CC=C4)C#N

Isomeric SMILES

CCCC1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCCC4=CC=CC=C4)C#N

InChI

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