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

Systemtic Name: N-[(3-chloranyl-4,5-diethoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[(3-chloro-4,5-diethoxy-phenyl)methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[(3-chloro-4,5-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[(3-chloro-4,5-diethoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine Traditional Name: (3-chloro-4,5-diethoxy-benzyl)-(1H-1,2,4-triazol-5-yl)amine Formula: C13H17ClN4O2 MolecularWeight: 296.75268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC

InChI

InChI=1S/C13H17ClN4O2/c1-3-19-11-6-9(5-10(14)12(11)20-4-2)7-15-13-16-8-17-18-13/h5-6,8H,3-4,7H2,1-2H3,(H2,15,16,17,18)