2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinazolin-4-one Formula: C14H20N4O+2 MolecularWeight: 260.3348

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C14H18N4O/c1-17-6-8-18(9-7-17)10-13-15-12-5-3-2-4-11(12)14(19)16-13/h2-5H,6-10H2,1H3,(H,15,16,19)/p+2