methyl 2-phenyl-2-(1,2,4-triazol-1-yl)ethanoate

Systemtic Name: methyl 2-phenyl-2-(1,2,4-triazol-1-yl)ethanoate Openeye Name: methyl 2-phenyl-2-(1,2,4-triazol-1-yl)acetate CAS Name: 2-phenyl-2-(1,2,4-triazol-1-yl)acetic acid methyl ester IUPAC Name: methyl 2-phenyl-2-(1,2,4-triazol-1-yl)acetate Traditional Name: 2-phenyl-2-(1,2,4-triazol-1-yl)acetic acid methyl ester Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2C=NC=N2

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2C=NC=N2

InChI

InChI=1S/C11H11N3O2/c1-16-11(15)10(14-8-12-7-13-14)9-5-3-2-4-6-9/h2-8,10H,1H3