6-[3-[3,5-bis(chloranyl)phenyl]-4-oxidanylidene-phthalazin-1-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[3,5-bis(chloranyl)phenyl]-4-oxidanylidene-phthalazin-1-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(3,5-dichlorophenyl)-4-oxo-phthalazin-1-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(3,5-dichlorophenyl)-4-oxo-1-phthalazinyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(3,5-dichlorophenyl)-4-oxophthalazin-1-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(3,5-dichlorophenyl)-4-keto-phthalazin-1-yl]-4H-1,4-benzoxazin-3-one Formula: C22H13Cl2N3O3 MolecularWeight: 438.26292

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC(=C5)Cl)Cl

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C3=NN(C(=O)C4=CC=CC=C43)C5=CC(=CC(=C5)Cl)Cl

InChI

InChI=1S/C22H13Cl2N3O3/c23-13-8-14(24)10-15(9-13)27-22(29)17-4-2-1-3-16(17)21(26-27)12-5-6-19-18(7-12)25-20(28)11-30-19/h1-10H,11H2,(H,25,28)