5-(4-chloranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one

Systemtic Name: 5-(4-chloranylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Openeye Name: 5-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one CAS Name: 5-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-pentanone IUPAC Name: 5-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Traditional Name: 5-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)pentan-2-one Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOC1=CC=C(C=C1)Cl)C(=O)CN2C=NC=N2

Isomeric SMILES

CC(C)(CCOC1=CC=C(C=C1)Cl)C(=O)CN2C=NC=N2

InChI

InChI=1S/C15H18ClN3O2/c1-15(2,14(20)9-19-11-17-10-18-19)7-8-21-13-5-3-12(16)4-6-13/h3-6,10-11H,7-9H2,1-2H3