1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-3-methyl-butan-1-one CAS Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[5-(2-chlorophenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-3-methylbutan-1-one Traditional Name: 1-[5-(2-chlorophenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Formula: C17H22ClN3O2 MolecularWeight: 335.82848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(=NC(=N1)OCC(C)C)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)CC(=O)N1C(=NC(=N1)OCC(C)C)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H22ClN3O2/c1-11(2)9-15(22)21-16(13-7-5-6-8-14(13)18)19-17(20-21)23-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3