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

Systemtic Name: N-[[4-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-[[4-[(3-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-1H-1,2,4-triazol-5-amine CAS Name: N-[[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-1H-1,2,4-triazol-5-amine IUPAC Name: N-[[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]methyl]-1H-1,2,4-triazol-5-amine Traditional Name: [4-(3-chlorobenzyl)oxy-3-methoxy-benzyl]-(1H-1,2,4-triazol-5-yl)amine Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=NC=NN2)OCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=NC=NN2)OCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H17ClN4O2/c1-23-16-8-12(9-19-17-20-11-21-22-17)5-6-15(16)24-10-13-3-2-4-14(18)7-13/h2-8,11H,9-10H2,1H3,(H2,19,20,21,22)