5-[6,8-bis(chloranyl)-2-oxidanyl-4H-1,4-benzoxazin-3-yl]-3-nitro-cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 5-[6,8-bis(chloranyl)-2-oxidanyl-4H-1,4-benzoxazin-3-yl]-3-nitro-cyclohexa-3,5-diene-1,2-dione Openeye Name: 5-(6,8-dichloro-2-hydroxy-4H-1,4-benzoxazin-3-yl)-3-nitro-1,2-benzoquinone CAS Name: 5-(6,8-dichloro-2-hydroxy-4H-1,4-benzoxazin-3-yl)-3-nitrocyclohexa-3,5-diene-1,2-dione IUPAC Name: 5-(6,8-dichloro-2-hydroxy-4H-1,4-benzoxazin-3-yl)-3-nitrocyclohexa-3,5-diene-1,2-dione Traditional Name: 5-(6,8-dichloro-2-hydroxy-4H-1,4-benzoxazin-3-yl)-3-nitro-o-benzoquinone Formula: C14H6Cl2N2O6 MolecularWeight: 369.11324

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=O)C1=O)[N+](=O)[O-])C2=C(OC3=C(C=C(C=C3N2)Cl)Cl)O

Isomeric SMILES

C1=C(C=C(C(=O)C1=O)[N+](=O)[O-])C2=C(OC3=C(C=C(C=C3N2)Cl)Cl)O

InChI

InChI=1S/C14H6Cl2N2O6/c15-6-3-7(16)13-8(4-6)17-11(14(21)24-13)5-1-9(18(22)23)12(20)10(19)2-5/h1-4,17,21H