1-[6-chloranyl-2-nitro-3,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[6-chloranyl-2-nitro-3,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(6-chloro-3,4-dihydroxy-2-nitro-phenyl)ethanone CAS Name: 1-(6-chloro-3,4-dihydroxy-2-nitrophenyl)ethanone IUPAC Name: 1-(6-chloro-3,4-dihydroxy-2-nitrophenyl)ethanone Traditional Name: 1-(6-chloro-3,4-dihydroxy-2-nitro-phenyl)ethanone Formula: C8H6ClNO5 MolecularWeight: 231.58994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

Isomeric SMILES

CC(=O)C1=C(C=C(C(=C1[N+](=O)[O-])O)O)Cl

InChI

InChI=1S/C8H6ClNO5/c1-3(11)6-4(9)2-5(12)8(13)7(6)10(14)15/h2,12-13H,1H3