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

Systemtic Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[5-(3-chlorophenyl)-3-ethoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Formula: C19H26ClN3O2 MolecularWeight: 363.88164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC(=CC=C2)Cl)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC(=CC=C2)Cl)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C19H26ClN3O2/c1-6-25-18-21-17(14-8-7-9-15(20)11-14)23(22-18)16(24)10-13(2)12-19(3,4)5/h7-9,11,13H,6,10,12H2,1-5H3