4-[(E)-4-(dimethylamino)-2-oxidanylidene-but-3-enoxy]-2H-phthalazin-1-one

Systemtic Name: 4-[(E)-4-(dimethylamino)-2-oxidanylidene-but-3-enoxy]-2H-phthalazin-1-one Openeye Name: 4-[(E)-4-(dimethylamino)-2-oxo-but-3-enoxy]-2H-phthalazin-1-one CAS Name: 4-[(E)-4-(dimethylamino)-2-oxobut-3-enoxy]-2H-phthalazin-1-one IUPAC Name: 4-[(E)-4-(dimethylamino)-2-oxobut-3-enoxy]-2H-phthalazin-1-one Traditional Name: 4-[(E)-4-(dimethylamino)-2-keto-but-3-enoxy]-2H-phthalazin-1-one Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=CC(=O)COC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CN(C)/C=C/C(=O)COC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H15N3O3/c1-17(2)8-7-10(18)9-20-14-12-6-4-3-5-11(12)13(19)15-16-14/h3-8H,9H2,1-2H3,(H,15,19)/b8-7+