2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-oxo-3-phenyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-oxo-3-phenylphthalazine-1-carboxylate Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid 2-phthalimidoethyl ester Formula: C25H17N3O5 MolecularWeight: 439.41958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H17N3O5/c29-22-19-12-6-7-13-20(19)23(30)27(22)14-15-33-25(32)21-17-10-4-5-11-18(17)24(31)28(26-21)16-8-2-1-3-9-16/h1-13H,14-15H2