2-[(4-cyclobutylcarbonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-cyclobutylcarbonylpiperazin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-(cyclobutanecarbonyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-[cyclobutyl(oxo)methyl]-1-piperazin-1-iumyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(cyclobutanecarbonyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[4-(cyclobutanecarbonyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CC[NH+](CC2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CC(C1)C(=O)N2CC[NH+](CC2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H22N4O2/c23-17-14-6-1-2-7-15(14)19-16(20-17)12-21-8-10-22(11-9-21)18(24)13-4-3-5-13/h1-2,6-7,13H,3-5,8-12H2,(H,19,20,23)/p+1