5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]quinoline

Systemtic Name: 5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]quinoline Openeye Name: 5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]quinoline CAS Name: 5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)-1-piperazinyl]methyl]quinoline IUPAC Name: 5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)piperazin-1-yl]methyl]quinoline Traditional Name: 5-[[4-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-3-ium-4-yl)piperazino]methyl]quinoline Formula: C27H28N5+ MolecularWeight: 422.54472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C([NH+]=C2N3CCN(CC3)CC4=C5C=CC=NC5=CC=C4)C6=CC=CC=C6

Isomeric SMILES

C1CC2=C(C1)N=C([NH+]=C2N3CCN(CC3)CC4=C5C=CC=NC5=CC=C4)C6=CC=CC=C6

InChI

InChI=1S/C27H27N5/c1-2-7-20(8-3-1)26-29-25-13-5-10-23(25)27(30-26)32-17-15-31(16-18-32)19-21-9-4-12-24-22(21)11-6-14-28-24/h1-4,6-9,11-12,14H,5,10,13,15-19H2/p+1