N-[(3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-[(3-chloranyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[(4-allyloxy-3-chloro-5-methoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(3-chloro-5-methoxy-4-prop-2-enoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Traditional Name: (4-allyloxy-3-chloro-5-methoxy-benzyl)-(1H-1,2,4-triazol-5-yl)amine Formula: C13H15ClN4O2 MolecularWeight: 294.7368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC=C

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC=C

InChI

InChI=1S/C13H15ClN4O2/c1-3-4-20-12-10(14)5-9(6-11(12)19-2)7-15-13-16-8-17-18-13/h3,5-6,8H,1,4,7H2,2H3,(H2,15,16,17,18)