5-(3-oxidanylpropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one

Systemtic Name: 5-(3-oxidanylpropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Openeye Name: 5-(3-hydroxypropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one CAS Name: 5-(3-hydroxypropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one IUPAC Name: 5-(3-hydroxypropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Traditional Name: 5-(3-hydroxypropylamino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Formula: C18H17N4O2+ MolecularWeight: 321.35318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=[N+](C(=O)C4=CC=CC=C4N3)N=C2NCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C3=[N+](C(=O)C4=CC=CC=C4N3)N=C2NCCCO

InChI

InChI=1S/C18H16N4O2/c23-11-5-10-19-16-12-6-1-2-7-13(12)17-20-15-9-4-3-8-14(15)18(24)22(17)21-16/h1-4,6-9,23H,5,10-11H2,(H,19,21)/p+1