(2-methylphenyl)-[3-nitro-4,5-bis(oxidanyl)phenyl]methanone

Systemtic Name: (2-methylphenyl)-[3-nitro-4,5-bis(oxidanyl)phenyl]methanone Openeye Name: (3,4-dihydroxy-5-nitro-phenyl)-(o-tolyl)methanone CAS Name: (3,4-dihydroxy-5-nitrophenyl)-(2-methylphenyl)methanone IUPAC Name: (3,4-dihydroxy-5-nitrophenyl)-(2-methylphenyl)methanone Traditional Name: (3,4-dihydroxy-5-nitro-phenyl)-(o-tolyl)methanone Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO5/c1-8-4-2-3-5-10(8)13(17)9-6-11(15(19)20)14(18)12(16)7-9/h2-7,16,18H,1H3