ethyl 1-[(4-methoxyphenyl)methyl]-5-oxidanylidene-2H-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-[(4-methoxyphenyl)methyl]-5-oxidanylidene-2H-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-[(4-methoxyphenyl)methyl]-5-oxo-2H-triazole-4-carboxylate CAS Name: 1-[(4-methoxyphenyl)methyl]-5-oxo-2H-triazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methoxyphenyl)methyl]-5-oxo-2H-triazole-4-carboxylate Traditional Name: 5-keto-1-p-anisyl-2H-triazole-4-carboxylic acid ethyl ester Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNN(C1=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=NNN(C1=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C13H15N3O4/c1-3-20-13(18)11-12(17)16(15-14-11)8-9-4-6-10(19-2)7-5-9/h4-7,15H,3,8H2,1-2H3