1-[3-methyl-5-nitro-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[3-methyl-5-nitro-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(2,4-dihydroxy-3-methyl-5-nitro-phenyl)ethanone CAS Name: 1-(2,4-dihydroxy-3-methyl-5-nitrophenyl)ethanone IUPAC Name: 1-(2,4-dihydroxy-3-methyl-5-nitrophenyl)ethanone Traditional Name: 1-(2,4-dihydroxy-3-methyl-5-nitro-phenyl)ethanone Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1O)[N+](=O)[O-])C(=O)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1O)[N+](=O)[O-])C(=O)C)O

InChI

InChI=1S/C9H9NO5/c1-4-8(12)6(5(2)11)3-7(9(4)13)10(14)15/h3,12-13H,1-2H3