1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[3-butoxy-5-(3-chlorophenyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Formula: C17H22ClN3O2 MolecularWeight: 335.82848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC(=CC=C2)Cl)C(=O)C(C)(C)C

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC(=CC=C2)Cl)C(=O)C(C)(C)C

InChI

InChI=1S/C17H22ClN3O2/c1-5-6-10-23-16-19-14(12-8-7-9-13(18)11-12)21(20-16)15(22)17(2,3)4/h7-9,11H,5-6,10H2,1-4H3