1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methyl-butan-1-one

Systemtic Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methyl-butan-1-one Openeye Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methyl-butan-1-one CAS Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methyl-1-butanone IUPAC Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methylbutan-1-one Traditional Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-3-methyl-butan-1-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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