N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethoxyphenyl)-4-keto-phthalazine-1-carboxamide Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC5=C(C=C4)OCCO5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC5=C(C=C4)OCCO5)OC

InChI

InChI=1S/C25H21N3O6/c1-31-17-12-16(13-18(14-17)32-2)28-25(30)20-6-4-3-5-19(20)23(27-28)24(29)26-15-7-8-21-22(11-15)34-10-9-33-21/h3-8,11-14H,9-10H2,1-2H3,(H,26,29)