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

Systemtic Name: N1-[(5-bromanyl-2-prop-2-enoxy-phenyl)methyl]-1,2,3,4-tetrazole-1,5-diamine Openeye Name: N1-[(2-allyloxy-5-bromo-phenyl)methyl]tetrazole-1,5-diamine CAS Name: N1-[(5-bromo-2-prop-2-enoxyphenyl)methyl]tetrazole-1,5-diamine IUPAC Name: 1-N-[(5-bromo-2-prop-2-enoxyphenyl)methyl]tetrazole-1,5-diamine Traditional Name: (2-allyloxy-5-bromo-benzyl)-(5-aminotetrazol-1-yl)amine Formula: C11H13BrN6O MolecularWeight: 325.16452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrN6O/c1-2-5-19-10-4-3-9(12)6-8(10)7-14-18-11(13)15-16-17-18/h2-4,6,14H,1,5,7H2,(H2,13,15,17)