2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]-1H-quinazolin-4-one CAS Name: 2-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]-1H-quinazolin-4-one Traditional Name: 2-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]-1H-quinazolin-4-one Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H20N4O2/c1-19-8-10-20(11-9-19)15(21)7-6-14-17-13-5-3-2-4-12(13)16(22)18-14/h2-5H,6-11H2,1H3,(H,17,18,22)/p+1