3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-one

Systemtic Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-one Openeye Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-one CAS Name: 3-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-4-quinazolinone IUPAC Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-one Traditional Name: 3-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-4-one Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C20H22N4O2/c1-26-19-9-5-4-8-18(19)23-12-10-22(11-13-23)15-24-14-21-17-7-3-2-6-16(17)20(24)25/h2-9,14H,10-13,15H2,1H3/p+1