morpholin-4-yl-[3-oxidanyl-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]methanone

Systemtic Name: morpholin-4-yl-[3-oxidanyl-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]methanone Openeye Name: [3-hydroxy-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-2-naphthyl]-morpholino-methanone CAS Name: [3-hydroxy-4-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenyl]-(4-morpholinyl)methanone IUPAC Name: [3-hydroxy-4-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]naphthalen-2-yl]-morpholin-4-ylmethanone Traditional Name: [3-hydroxy-4-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]-2-naphthyl]-morpholino-methanone Formula: C24H28N5O3+ MolecularWeight: 434.51082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=NC=CC=N5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=NC=CC=N5

InChI

InChI=1S/C24H27N5O3/c30-22-20(23(31)28-12-14-32-15-13-28)16-18-4-1-2-5-19(18)21(22)17-27-8-10-29(11-9-27)24-25-6-3-7-26-24/h1-7,16,30H,8-15,17H2/p+1