N-[(2,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(2,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[(2,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[(2,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(2,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Traditional Name: 1H-1,2,4-triazol-5-yl-(2,4,5-trimethoxybenzyl)amine Formula: C12H16N4O3 MolecularWeight: 264.28044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC2=NC=NN2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC2=NC=NN2)OC)OC

InChI

InChI=1S/C12H16N4O3/c1-17-9-5-11(19-3)10(18-2)4-8(9)6-13-12-14-7-15-16-12/h4-5,7H,6H2,1-3H3,(H2,13,14,15,16)