N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-butyl-1,2,3,4-tetrazol-5-amine

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-butyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-2-butyl-tetrazol-5-amine CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-butyl-5-tetrazolamine IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-2-butyltetrazol-5-amine Traditional Name: (5-bromo-2-methoxy-benzyl)-(2-butyltetrazol-5-yl)amine Formula: C13H18BrN5O MolecularWeight: 340.21892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCCCN1N=C(N=N1)NCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C13H18BrN5O/c1-3-4-7-19-17-13(16-18-19)15-9-10-8-11(14)5-6-12(10)20-2/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17)