1-(5-phenyl-3-propan-2-yloxy-1,2,4-triazol-1-yl)hexan-1-one

Systemtic Name: 1-(5-phenyl-3-propan-2-yloxy-1,2,4-triazol-1-yl)hexan-1-one Openeye Name: 1-(3-isopropoxy-5-phenyl-1,2,4-triazol-1-yl)hexan-1-one CAS Name: 1-(5-phenyl-3-propan-2-yloxy-1,2,4-triazol-1-yl)-1-hexanone IUPAC Name: 1-(5-phenyl-3-propan-2-yloxy-1,2,4-triazol-1-yl)hexan-1-one Traditional Name: 1-(3-isopropoxy-5-phenyl-1,2,4-triazol-1-yl)hexan-1-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O2/c1-4-5-7-12-15(21)20-16(14-10-8-6-9-11-14)18-17(19-20)22-13(2)3/h6,8-11,13H,4-5,7,12H2,1-3H3