3-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[2-[2-(3-methylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[2-[2-(3-methylphenoxy)ethylamino]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-[2-keto-2-[2-(3-methylphenoxy)ethylamino]ethyl]phthalazin-1-olate Formula: C19H18N3O4- MolecularWeight: 352.36392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C19H19N3O4/c1-13-5-4-6-14(11-13)26-10-9-20-17(23)12-22-19(25)16-8-3-2-7-15(16)18(24)21-22/h2-8,11H,9-10,12H2,1H3,(H,20,23)(H,21,24)/p-1