5-methyl-2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione

Systemtic Name: 5-methyl-2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione Openeye Name: 5-methyl-2-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]isoindoline-1,3-dione CAS Name: 5-methyl-2-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione IUPAC Name: 5-methyl-2-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione Traditional Name: 2-[3-[(4-keto-3H-phthalazin-1-yl)methyl]phenyl]-5-methyl-isoindoline-1,3-quinone Formula: C24H17N3O3 MolecularWeight: 395.41008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H17N3O3/c1-14-9-10-19-20(11-14)24(30)27(23(19)29)16-6-4-5-15(12-16)13-21-17-7-2-3-8-18(17)22(28)26-25-21/h2-12H,13H2,1H3,(H,26,28)