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

Systemtic Name: 2-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione Openeye Name: 2-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]isoindoline-1,3-dione CAS Name: 2-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]isoindole-1,3-dione IUPAC Name: 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]isoindoline-1,3-quinone Formula: C23H15N3O3 MolecularWeight: 381.3835

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C23H15N3O3/c27-21-17-9-2-1-8-16(17)20(24-25-21)13-14-6-5-7-15(12-14)26-22(28)18-10-3-4-11-19(18)23(26)29/h1-12H,13H2,(H,25,27)