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

Systemtic Name: 2-(4-chloranylphenoxy)-4,4-dimethyl-1-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 2-(4-chlorophenoxy)-4,4-dimethyl-1-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 2-(4-chlorophenoxy)-4,4-dimethyl-1-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 2-(4-chlorophenoxy)-4,4-dimethyl-1-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 2-(4-chlorophenoxy)-4,4-dimethyl-1-(1,2,4-triazol-1-yl)pentan-3-one Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CN1C=NC=N1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C(=O)C(CN1C=NC=N1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-15(2,3)14(20)13(8-19-10-17-9-18-19)21-12-6-4-11(16)5-7-12/h4-7,9-10,13H,8H2,1-3H3