1-[5-chloranyl-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[5-chloranyl-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[5-chloro-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethyl-propan-1-one CAS Name: 1-[5-chloro-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[5-chloro-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethylpropan-1-one Traditional Name: 1-[5-chloro-2-(1,2,4-triazol-1-ylmethoxy)phenyl]-2,2-dimethyl-propan-1-one Formula: C14H16ClN3O2 MolecularWeight: 293.74874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=C(C=CC(=C1)Cl)OCN2C=NC=N2

Isomeric SMILES

CC(C)(C)C(=O)C1=C(C=CC(=C1)Cl)OCN2C=NC=N2

InChI

InChI=1S/C14H16ClN3O2/c1-14(2,3)13(19)11-6-10(15)4-5-12(11)20-9-18-8-16-7-17-18/h4-8H,9H2,1-3H3