N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine

Systemtic Name: N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Openeye Name: N-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine CAS Name: N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine IUPAC Name: N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine Traditional Name: (2-bromo-4,5-dimethoxy-benzyl)-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]amine Formula: C14H19BrN4O2 MolecularWeight: 355.23026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C)NCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CC(C1=NN=CN1C)NCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C14H19BrN4O2/c1-9(14-18-17-8-19(14)2)16-7-10-5-12(20-3)13(21-4)6-11(10)15/h5-6,8-9,16H,7H2,1-4H3