4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-oxo-2-(p-tolyl)ethyl]phthalazin-1-one CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylphenyl)-2-oxoethyl]-1-phthalazinone IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(4-methylphenyl)-2-oxoethyl]phthalazin-1-one Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-keto-2-(p-tolyl)ethyl]phthalazin-1-one Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H20N2O4/c1-16-6-8-17(9-7-16)21(28)15-27-25(29)20-5-3-2-4-19(20)24(26-27)18-10-11-22-23(14-18)31-13-12-30-22/h2-11,14H,12-13,15H2,1H3