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

Systemtic Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)piperazin-1-ium-1-yl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)piperazin-1-ium-1-yl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)-1-piperazin-1-iumyl]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[4-(4-cyano-1-phenyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)piperazin-1-ium-1-yl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[4-(4-cyano-1-phenyl-2-pyrindan-3-yl)piperazin-1-ium-1-yl]-N-(3-methoxyphenyl)acetamide Formula: C28H30N5O2+ MolecularWeight: 468.5701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C[NH+]2CCN(CC2)C3=NC(=C4CCCC4=C3C#N)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C[NH+]2CCN(CC2)C3=NC(=C4CCCC4=C3C#N)C5=CC=CC=C5

InChI

InChI=1S/C28H29N5O2/c1-35-22-10-5-9-21(17-22)30-26(34)19-32-13-15-33(16-14-32)28-25(18-29)23-11-6-12-24(23)27(31-28)20-7-3-2-4-8-20/h2-5,7-10,17H,6,11-16,19H2,1H3,(H,30,34)/p+1