ethyl 1-(4-oxidanylidene-2,3-dihydrochromen-3-yl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-oxidanylidene-2,3-dihydrochromen-3-yl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-oxochroman-3-yl)triazole-4-carboxylate CAS Name: 1-(4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-oxo-2,3-dihydrochromen-3-yl)triazole-4-carboxylate Traditional Name: 1-(4-ketochroman-3-yl)triazole-4-carboxylic acid ethyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=N1)C2COC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=CN(N=N1)C2COC3=CC=CC=C3C2=O

InChI

InChI=1S/C14H13N3O4/c1-2-20-14(19)10-7-17(16-15-10)11-8-21-12-6-4-3-5-9(12)13(11)18/h3-7,11H,2,8H2,1H3