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

Systemtic Name: O1-ethyl O3-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C16H15N3O8 MolecularWeight: 377.3056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=NOC(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=NOC(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O8/c1-3-25-15(21)10-5-11(7-12(6-10)19(23)24)16(22)26-8-14(20)17-13-4-9(2)27-18-13/h4-7H,3,8H2,1-2H3,(H,17,18,20)