ethyl 2-[5-azanyl-1-(phenylcarbonyl)-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[5-azanyl-1-(phenylcarbonyl)-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-(5-amino-1-benzoyl-1,2,4-triazol-3-yl)acetate CAS Name: 2-(5-amino-1-benzoyl-1,2,4-triazol-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-amino-1-benzoyl-1,2,4-triazol-3-yl)acetate Traditional Name: 2-(5-amino-1-benzoyl-1,2,4-triazol-3-yl)acetic acid ethyl ester Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=N1)N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC1=NN(C(=N1)N)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14N4O3/c1-2-20-11(18)8-10-15-13(14)17(16-10)12(19)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,14,15,16)