5-(4-methylpiperazin-4-ium-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one

Systemtic Name: 5-(4-methylpiperazin-4-ium-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Openeye Name: 5-(4-methylpiperazin-4-ium-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one CAS Name: 5-(4-methyl-1-piperazin-4-iumyl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one IUPAC Name: 5-(4-methylpiperazin-4-ium-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Traditional Name: 5-(4-methylpiperazin-4-ium-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Formula: C20H21N5O+2 MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=N[N+]3=C(C4=CC=CC=C42)NC5=CC=CC=C5C3=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=N[N+]3=C(C4=CC=CC=C42)NC5=CC=CC=C5C3=O

InChI

InChI=1S/C20H19N5O/c1-23-10-12-24(13-11-23)19-15-7-3-2-6-14(15)18-21-17-9-5-4-8-16(17)20(26)25(18)22-19/h2-9H,10-13H2,1H3/p+2