1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloranyl-2,2-dimethyl-propan-1-one

Systemtic Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloranyl-2,2-dimethyl-propan-1-one Openeye Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloro-2,2-dimethyl-propan-1-one CAS Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloro-2,2-dimethyl-1-propanone IUPAC Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloro-2,2-dimethylpropan-1-one Traditional Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-chloro-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)C(=O)C(C)(C)CCl

Isomeric SMILES

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

InChI

InChI=1S/C17H22ClN3O2/c1-4-5-11-23-16-19-14(13-9-7-6-8-10-13)21(20-16)15(22)17(2,3)12-18/h6-10H,4-5,11-12H2,1-3H3