6-methyl-2-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 6-methyl-2-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 6-methyl-2-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 6-methyl-2-[[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 6-methyl-2-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 6-methyl-2-[[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C22H28N4O2+2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)C[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)C[NH+]3CC[NH+](CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2/c1-18-6-5-9-21-23-19(16-22(27)26(18)21)17-25-12-10-24(11-13-25)14-15-28-20-7-3-2-4-8-20/h2-9,16H,10-15,17H2,1H3/p+2