1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]octan-1-one

Systemtic Name: 1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]octan-1-one Openeye Name: 1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]octan-1-one CAS Name: 1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-1-octanone IUPAC Name: 1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]octan-1-one Traditional Name: 1-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]octan-1-one Formula: C22H33N3O2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1C(=NC(=N1)OCCCC)C2=CC=C(C=C2)CC

Isomeric SMILES

CCCCCCCC(=O)N1C(=NC(=N1)OCCCC)C2=CC=C(C=C2)CC

InChI

InChI=1S/C22H33N3O2/c1-4-7-9-10-11-12-20(26)25-21(19-15-13-18(6-3)14-16-19)23-22(24-25)27-17-8-5-2/h13-16H,4-12,17H2,1-3H3