(E)-1-[5-(4-methylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[5-(4-methylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[3-propoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]prop-2-en-1-one CAS Name: (E)-1-[5-(4-methylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[5-(4-methylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-3-phenyl-1-[3-propoxy-5-(p-tolyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=C(C=C2)C)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O2/c1-3-15-26-21-22-20(18-12-9-16(2)10-13-18)24(23-21)19(25)14-11-17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3/b14-11+