2-(3-chloranylphenoxy)ethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: 2-(3-chloranylphenoxy)ethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: 2-(3-chlorophenoxy)ethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid 2-(3-chlorophenoxy)ethyl ester IUPAC Name: 2-(3-chlorophenoxy)ethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid 2-(3-chlorophenoxy)ethyl ester Formula: C18H16ClN3O3 MolecularWeight: 357.79094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCCOC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCCOC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H16ClN3O3/c19-16-2-1-3-17(10-16)24-8-9-25-18(23)15-6-4-14(5-7-15)11-22-13-20-12-21-22/h1-7,10,12-13H,8-9,11H2