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

Systemtic Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)decan-1-one Openeye Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)decan-1-one CAS Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)-1-decanone IUPAC Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)decan-1-one Traditional Name: 1-(3-butoxy-5-phenyl-1,2,4-triazol-1-yl)decan-1-one Formula: C22H33N3O2 MolecularWeight: 371.51632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)N1C(=NC(=N1)OCCCC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC(=O)N1C(=NC(=N1)OCCCC)C2=CC=CC=C2

InChI

InChI=1S/C22H33N3O2/c1-3-5-7-8-9-10-14-17-20(26)25-21(19-15-12-11-13-16-19)23-22(24-25)27-18-6-4-2/h11-13,15-16H,3-10,14,17-18H2,1-2H3