methyl 2-[2-(2-nitro-5-oxidanyl-phenyl)ethanoyl]-5-oxidanyl-benzoate

Systemtic Name: methyl 2-[2-(2-nitro-5-oxidanyl-phenyl)ethanoyl]-5-oxidanyl-benzoate Openeye Name: methyl 5-hydroxy-2-[2-(5-hydroxy-2-nitro-phenyl)acetyl]benzoate CAS Name: 5-hydroxy-2-[2-(5-hydroxy-2-nitrophenyl)-1-oxoethyl]benzoic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-[2-(5-hydroxy-2-nitrophenyl)acetyl]benzoate Traditional Name: 5-hydroxy-2-[2-(5-hydroxy-2-nitro-phenyl)acetyl]benzoic acid methyl ester Formula: C16H13NO7 MolecularWeight: 331.27692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)O)C(=O)CC2=C(C=CC(=C2)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)O)C(=O)CC2=C(C=CC(=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7/c1-24-16(21)13-8-11(19)2-4-12(13)15(20)7-9-6-10(18)3-5-14(9)17(22)23/h2-6,8,18-19H,7H2,1H3