O3-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methyl] ester O1-ethyl ester IUPAC Name: 3-O-[[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl] ester O1-ethyl ester Formula: C23H22N2O8S MolecularWeight: 486.49438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OCC)OC

InChI

InChI=1S/C23H22N2O8S/c1-4-31-19-7-6-14(11-20(19)30-3)21-24-17(13-34-21)12-33-23(27)16-8-15(22(26)32-5-2)9-18(10-16)25(28)29/h6-11,13H,4-5,12H2,1-3H3