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

Systemtic Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-2-oxo-acetamide CAS Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)-1-piperazinyl]-2-oxoacetamide IUPAC Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-2-oxoacetamide Traditional Name: 2-[4-(4-cyano-1-phenyl-2-pyrindan-2-ium-3-yl)piperazino]-2-keto-acetamide Formula: C21H22N5O2+ MolecularWeight: 376.43168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=[NH+]C(=C2C1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C(=O)N)C#N

Isomeric SMILES

C1CC2=C(C(=[NH+]C(=C2C1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C(=O)N)C#N

InChI

InChI=1S/C21H21N5O2/c22-13-17-15-7-4-8-16(15)18(14-5-2-1-3-6-14)24-20(17)25-9-11-26(12-10-25)21(28)19(23)27/h1-3,5-6H,4,7-12H2,(H2,23,27)/p+1