O1-ethyl O3-methyl 4-methyl-2-(2-nitrophenyl)-6-oxidanyl-benzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-methyl 4-methyl-2-(2-nitrophenyl)-6-oxidanyl-benzene-1,3-dicarboxylate Openeye Name: O3-ethyl O1-methyl 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylate CAS Name: 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester IUPAC Name: 3-O-ethyl 1-O-methyl 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylate Traditional Name: 4-hydroxy-6-methyl-2-(2-nitrophenyl)benzene-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester Formula: C18H17NO7 MolecularWeight: 359.33008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C(=C1C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)C)O

Isomeric SMILES

CCOC(=O)C1=C(C=C(C(=C1C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)C)O

InChI

InChI=1S/C18H17NO7/c1-4-26-18(22)16-13(20)9-10(2)14(17(21)25-3)15(16)11-7-5-6-8-12(11)19(23)24/h5-9,20H,4H2,1-3H3