2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-2-oxidanylidene-N-(3-oxidanylpropyl)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-N-(3-oxidanylpropyl)ethanamide Openeye Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-N-(3-hydroxypropyl)-2-oxo-acetamide CAS Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)-1-piperazinyl]-N-(3-hydroxypropyl)-2-oxoacetamide IUPAC Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-yl]-N-(3-hydroxypropyl)-2-oxoacetamide Traditional Name: 2-[4-(4-cyano-1-phenyl-2-pyrindan-2-ium-3-yl)piperazino]-N-(3-hydroxypropyl)-2-keto-acetamide Formula: C24H28N5O3+ MolecularWeight: 434.51082

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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)NCCCO)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H27N5O3/c25-16-20-18-8-4-9-19(18)21(17-6-2-1-3-7-17)27-22(20)28-11-13-29(14-12-28)24(32)23(31)26-10-5-15-30/h1-3,6-7,30H,4-5,8-15H2,(H,26,31)/p+1