1-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-(2,4,6-trimethylphenyl)ethanone

Systemtic Name: 1-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-(2,4,6-trimethylphenyl)ethanone Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-(2,4,6-trimethylphenyl)ethanone CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(2,4,6-trimethylphenyl)ethanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(2,4,6-trimethylphenyl)ethanone Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-mesityl-ethanone Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])C

InChI

InChI=1S/C17H17NO5/c1-9-4-10(2)13(11(3)5-9)8-15(19)12-6-14(18(22)23)17(21)16(20)7-12/h4-7,20-21H,8H2,1-3H3