3-(4-chloranyl-3-nitro-phenyl)-2H-phthalazine-1,4-dione

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-2H-phthalazine-1,4-dione Openeye Name: 3-(4-chloro-3-nitro-phenyl)-2H-phthalazine-1,4-dione CAS Name: 3-(4-chloro-3-nitrophenyl)-2H-phthalazine-1,4-dione IUPAC Name: 3-(4-chloro-3-nitrophenyl)-2H-phthalazine-1,4-dione Traditional Name: 3-(4-chloro-3-nitro-phenyl)-2H-phthalazine-1,4-quinone Formula: C14H8ClN3O4 MolecularWeight: 317.68402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H8ClN3O4/c15-11-6-5-8(7-12(11)18(21)22)17-14(20)10-4-2-1-3-9(10)13(19)16-17/h1-7H,(H,16,19)