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-(phenylmethyl)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-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(4-cyano-1-isopropyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-ium-1-yl]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-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(4-cyano-1-propan-2-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-3-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(4-cyano-1-isopropyl-2-pyrindan-2-ium-3-yl)piperazin-1-ium-1-yl]acetamide Formula: C25H33N5O+2 MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4)C#N

Isomeric SMILES

CC(C)C1=C2CCCC2=C(C(=[NH+]1)N3CC[NH+](CC3)CC(=O)NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C25H31N5O/c1-18(2)24-21-10-6-9-20(21)22(15-26)25(28-24)30-13-11-29(12-14-30)17-23(31)27-16-19-7-4-3-5-8-19/h3-5,7-8,18H,6,9-14,16-17H2,1-2H3,(H,27,31)/p+2