1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[5-(4-chlorophenyl)-3-methoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Formula: C18H24ClN3O2 MolecularWeight: 349.85506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1C(=NC(=N1)OC)C2=CC=C(C=C2)Cl)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)N1C(=NC(=N1)OC)C2=CC=C(C=C2)Cl)CC(C)(C)C

InChI

InChI=1S/C18H24ClN3O2/c1-12(11-18(2,3)4)10-15(23)22-16(20-17(21-22)24-5)13-6-8-14(19)9-7-13/h6-9,12H,10-11H2,1-5H3