2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline

Systemtic Name: 2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline Openeye Name: 2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline CAS Name: 2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline IUPAC Name: 2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]aniline Traditional Name: [2-[3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazol-5-yl]phenyl]amine Formula: C17H18N4O3 MolecularWeight: 326.34982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NNC(=N2)C3=CC=CC=C3N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NNC(=N2)C3=CC=CC=C3N

InChI

InChI=1S/C17H18N4O3/c1-22-13-8-10(9-14(23-2)15(13)24-3)16-19-17(21-20-16)11-6-4-5-7-12(11)18/h4-9H,18H2,1-3H3,(H,19,20,21)