(2-oxidanylidene-2-phenylazanyl-ethyl) 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: (2-anilino-2-oxo-ethyl) 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (2-anilino-2-keto-ethyl) ester Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O3/c23-17(21-16-4-2-1-3-5-16)11-25-18(24)15-8-6-14(7-9-15)10-22-13-19-12-20-22/h1-9,12-13H,10-11H2,(H,21,23)