N1-[(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl]-1,2,3,4-tetrazole-1,5-diamine

Systemtic Name: N1-[(3-bromanyl-5-ethoxy-4-prop-2-enoxy-phenyl)methyl]-1,2,3,4-tetrazole-1,5-diamine Openeye Name: N1-[(4-allyloxy-3-bromo-5-ethoxy-phenyl)methyl]tetrazole-1,5-diamine CAS Name: N1-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methyl]tetrazole-1,5-diamine IUPAC Name: 1-N-[(3-bromo-5-ethoxy-4-prop-2-enoxyphenyl)methyl]tetrazole-1,5-diamine Traditional Name: (4-allyloxy-3-bromo-5-ethoxy-benzyl)-(5-aminotetrazol-1-yl)amine Formula: C13H17BrN6O2 MolecularWeight: 369.21708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Br)OCC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Br)OCC=C

InChI

InChI=1S/C13H17BrN6O2/c1-3-5-22-12-10(14)6-9(7-11(12)21-4-2)8-16-20-13(15)17-18-19-20/h3,6-7,16H,1,4-5,8H2,2H3,(H2,15,17,19)