N1-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1,2,3,4-tetrazole-1,5-diamine

Systemtic Name: N1-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1,2,3,4-tetrazole-1,5-diamine Openeye Name: N1-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]tetrazole-1,5-diamine CAS Name: N1-[[3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]tetrazole-1,5-diamine IUPAC Name: 1-N-[[3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]tetrazole-1,5-diamine Traditional Name: (5-aminotetrazol-1-yl)-[3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]amine Formula: C15H16BrN7O2 MolecularWeight: 406.23724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Br)OCC3=CN=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)CNN2C(=NN=N2)N)Br)OCC3=CN=CC=C3

InChI

InChI=1S/C15H16BrN7O2/c1-24-13-6-11(8-19-23-15(17)20-21-22-23)5-12(16)14(13)25-9-10-3-2-4-18-7-10/h2-7,19H,8-9H2,1H3,(H2,17,20,22)