1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one CAS Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenyl-1-butanone IUPAC Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-phenyl-butan-1-one Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)C(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)C(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-4-6-16-29-23-24-21(18-12-14-19(28-3)15-13-18)26(25-23)22(27)20(5-2)17-10-8-7-9-11-17/h7-15,20H,4-6,16H2,1-3H3