O2,O3-bis(4-nitrophenyl) 1,4-dihydrophthalazine-2,3-dicarbothioate

Systemtic Name: O2,O3-bis(4-nitrophenyl) 1,4-dihydrophthalazine-2,3-dicarbothioate Openeye Name: O2,O3-bis(4-nitrophenyl) 1,4-dihydrophthalazine-2,3-dicarbothioate CAS Name: 1,4-dihydrophthalazine-2,3-dicarbothioic acid O2,O3-bis(4-nitrophenyl) ester IUPAC Name: 2-O,3-O-bis(4-nitrophenyl) 1,4-dihydrophthalazine-2,3-dicarbothioate Traditional Name: 1,4-dihydrophthalazine-2,3-dicarbothioic acid O2,O3-bis(4-nitrophenyl) ester Formula: C22H16N4O6S2 MolecularWeight: 496.51564

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN(N1C(=S)OC3=CC=C(C=C3)[N+](=O)[O-])C(=S)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2CN(N1C(=S)OC3=CC=C(C=C3)[N+](=O)[O-])C(=S)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O6S2/c27-25(28)17-5-9-19(10-6-17)31-21(33)23-13-15-3-1-2-4-16(15)14-24(23)22(34)32-20-11-7-18(8-12-20)26(29)30/h1-12H,13-14H2