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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-[3-nitro-4,5-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-(3,4-dimethoxyphenyl)ethanone CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(3,4-dimethoxyphenyl)ethanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(3,4-dimethoxyphenyl)ethanone Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-(3,4-dimethoxyphenyl)ethanone Formula: C16H15NO7 MolecularWeight: 333.2928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15NO7/c1-23-14-4-3-9(6-15(14)24-2)5-12(18)10-7-11(17(21)22)16(20)13(19)8-10/h3-4,6-8,19-20H,5H2,1-2H3