(1-oxidanylidene-1-phenyl-propan-2-yl) 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C19H17N3O3/c1-14(18(23)16-5-3-2-4-6-16)25-19(24)17-9-7-15(8-10-17)11-22-13-20-12-21-22/h2-10,12-14H,11H2,1H3