6,8,9-tris(chloranyl)-7-oxidanyl-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one

Systemtic Name: 6,8,9-tris(chloranyl)-7-oxidanyl-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one Openeye Name: 6,8,9-trichloro-7-hydroxy-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one CAS Name: 6,8,9-trichloro-7-hydroxy-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one IUPAC Name: 6,8,9-trichloro-7-hydroxy-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one Traditional Name: 6,8,9-trichloro-7-hydroxy-2-phenyl-4H-1,3,4-benzoxadiazepin-5-one Formula: C14H7Cl3N2O3 MolecularWeight: 357.57598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=O)C3=C(O2)C(=C(C(=C3Cl)O)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=O)C3=C(O2)C(=C(C(=C3Cl)O)Cl)Cl

InChI

InChI=1S/C14H7Cl3N2O3/c15-8-7-12(10(17)9(16)11(8)20)22-14(19-18-13(7)21)6-4-2-1-3-5-6/h1-5,20H,(H,18,21)