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

Systemtic Name: 2-phenyl-1-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)butan-1-one Openeye Name: 2-phenyl-1-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)butan-1-one CAS Name: 2-phenyl-1-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 2-phenyl-1-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)butan-1-one Traditional Name: 2-phenyl-1-(5-phenyl-3-propoxy-1,2,4-triazol-1-yl)butan-1-one Formula: C21H23N3O2 MolecularWeight: 349.42622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=CC=C2)C(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=CC=C2)C(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-3-15-26-21-22-19(17-13-9-6-10-14-17)24(23-21)20(25)18(4-2)16-11-7-5-8-12-16/h5-14,18H,3-4,15H2,1-2H3