2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)pentan-3-one

Systemtic Name: 2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 2,2-dimethyl-1-phenoxy-4-(1,2,4-triazol-1-yl)pentan-3-one Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)(C)COC1=CC=CC=C1)N2C=NC=N2

Isomeric SMILES

CC(C(=O)C(C)(C)COC1=CC=CC=C1)N2C=NC=N2

InChI

InChI=1S/C15H19N3O2/c1-12(18-11-16-10-17-18)14(19)15(2,3)9-20-13-7-5-4-6-8-13/h4-8,10-12H,9H2,1-3H3