O1-methyl O3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[[5-(2-thienyl)isoxazol-3-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[(5-thiophen-2-yl-3-isoxazolyl)methyl] ester IUPAC Name: 1-O-methyl 3-O-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[[5-(2-thienyl)isoxazol-3-yl]methyl] ester Formula: C17H12N2O7S MolecularWeight: 388.35138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

InChI=1S/C17H12N2O7S/c1-24-16(20)10-5-11(7-13(6-10)19(22)23)17(21)25-9-12-8-14(26-18-12)15-3-2-4-27-15/h2-8H,9H2,1H3