methyl 2-[4-(dimethylamino)-2-oxidanyl-phenyl]carbonyl-5-nitro-benzoate

Systemtic Name: methyl 2-[4-(dimethylamino)-2-oxidanyl-phenyl]carbonyl-5-nitro-benzoate Openeye Name: methyl 2-[4-(dimethylamino)-2-hydroxy-benzoyl]-5-nitro-benzoate CAS Name: 2-[[4-(dimethylamino)-2-hydroxyphenyl]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[4-(dimethylamino)-2-hydroxybenzoyl]-5-nitrobenzoate Traditional Name: 2-[4-(dimethylamino)-2-hydroxy-benzoyl]-5-nitro-benzoic acid methyl ester Formula: C17H16N2O6 MolecularWeight: 344.31874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O6/c1-18(2)10-4-7-13(15(20)9-10)16(21)12-6-5-11(19(23)24)8-14(12)17(22)25-3/h4-9,20H,1-3H3