4,5-dimethoxy-2-(4-nitrophenyl)carbonyl-benzoic acid

Systemtic Name: 4,5-dimethoxy-2-(4-nitrophenyl)carbonyl-benzoic acid Openeye Name: 4,5-dimethoxy-2-(4-nitrobenzoyl)benzoic acid CAS Name: 4,5-dimethoxy-2-[(4-nitrophenyl)-oxomethyl]benzoic acid IUPAC Name: 4,5-dimethoxy-2-(4-nitrobenzoyl)benzoic acid Traditional Name: 4,5-dimethoxy-2-(4-nitrobenzoyl)benzoic acid Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO7/c1-23-13-7-11(12(16(19)20)8-14(13)24-2)15(18)9-3-5-10(6-4-9)17(21)22/h3-8H,1-2H3,(H,19,20)