1-[5-bromanyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]-N-methyl-methanamine

Systemtic Name: 1-[5-bromanyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]-N-methyl-methanamine Openeye Name: 1-[5-bromo-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]-N-methyl-methanamine CAS Name: 1-[5-bromo-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]-N-methylmethanamine IUPAC Name: 1-[5-bromo-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]-N-methylmethanamine Traditional Name: [5-bromo-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]benzyl]-methyl-amine Formula: C13H17BrN4O MolecularWeight: 325.20428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)COC2=C(C=C(C=C2)Br)CNC

Isomeric SMILES

CC1=NN=C(N1C)COC2=C(C=C(C=C2)Br)CNC

InChI

InChI=1S/C13H17BrN4O/c1-9-16-17-13(18(9)3)8-19-12-5-4-11(14)6-10(12)7-15-2/h4-6,15H,7-8H2,1-3H3