[2,2-dimethyl-4-oxidanylidene-3-phenylmethoxy-4-(1H-1,2,4-triazol-5-ylamino)butyl] ethanoate

Systemtic Name: [2,2-dimethyl-4-oxidanylidene-3-phenylmethoxy-4-(1H-1,2,4-triazol-5-ylamino)butyl] ethanoate Openeye Name: [3-benzyloxy-2,2-dimethyl-4-oxo-4-(1H-1,2,4-triazol-5-ylamino)butyl] acetate CAS Name: acetic acid [2,2-dimethyl-4-oxo-3-phenylmethoxy-4-(1H-1,2,4-triazol-5-ylamino)butyl] ester IUPAC Name: [2,2-dimethyl-4-oxo-3-phenylmethoxy-4-(1H-1,2,4-triazol-5-ylamino)butyl] acetate Traditional Name: acetic acid [3-benzoxy-4-keto-2,2-dimethyl-4-(1H-1,2,4-triazol-5-ylamino)butyl] ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)C(C(=O)NC1=NC=NN1)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCC(C)(C)C(C(=O)NC1=NC=NN1)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22N4O4/c1-12(22)25-10-17(2,3)14(15(23)20-16-18-11-19-21-16)24-9-13-7-5-4-6-8-13/h4-8,11,14H,9-10H2,1-3H3,(H2,18,19,20,21,23)