ethyl 5-[6-(methylamino)-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[6-(methylamino)-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[6-(methylamino)-7-oxo-cyclohepta-1,3,5-trien-1-yl]isoxazole-3-carboxylate CAS Name: 5-[6-(methylamino)-7-oxo-1-cyclohepta-1,3,5-trienyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[6-(methylamino)-7-oxocyclohepta-1,3,5-trien-1-yl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[7-keto-6-(methylamino)cyclohepta-1,3,5-trien-1-yl]isoxazole-3-carboxylic acid ethyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=CC=CC=C(C2=O)NC

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=CC=CC=C(C2=O)NC

InChI

InChI=1S/C14H14N2O4/c1-3-19-14(18)11-8-12(20-16-11)9-6-4-5-7-10(15-2)13(9)17/h4-8H,3H2,1-2H3,(H,15,17)