5-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]phthalazine-1,4-dione

Systemtic Name: 5-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]phthalazine-1,4-dione Openeye Name: 5-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phthalazine-1,4-dione CAS Name: 5-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phthalazine-1,4-dione IUPAC Name: 5-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phthalazine-1,4-dione Traditional Name: 5-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)phthalazine-1,4-quinone Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)C3=CC=CC4=C3C(=O)N=NC4=O

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)C3=CC=CC4=C3C(=O)N=NC4=O

InChI

InChI=1S/C16H11N3O4/c20-13-10-6-3-7-11(12(10)14(21)18-17-13)19-15(22)8-4-1-2-5-9(8)16(19)23/h1-3,6-9H,4-5H2