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

Systemtic Name: methyl 2-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanoate Openeye Name: methyl 2-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)acetate CAS Name: 2-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)acetic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)acetate Traditional Name: 2-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)acetic acid methyl ester Formula: C11H10ClN3O2 MolecularWeight: 251.669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN3O2/c1-17-11(16)10(15-7-13-6-14-15)8-2-4-9(12)5-3-8/h2-7,10H,1H3