O3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester O1-methyl ester Formula: C17H15NO7S MolecularWeight: 377.3685

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO7S/c1-9-4-14(10(2)26-9)15(19)8-25-17(21)12-5-11(16(20)24-3)6-13(7-12)18(22)23/h4-7H,8H2,1-3H3