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

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1-ethyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]-1-ethyl-tetrazol-5-amine CAS Name: N-[[3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]-1-ethyl-5-tetrazolamine IUPAC Name: N-[[3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1-ethyltetrazol-5-amine Traditional Name: [3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]-(1-ethyltetrazol-5-yl)amine Formula: C17H19BrN6O2 MolecularWeight: 419.27576

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=N1)NCC2=CC(=C(C(=C2)Br)OCC3=CN=CC=C3)OC

Isomeric SMILES

CCN1C(=NN=N1)NCC2=CC(=C(C(=C2)Br)OCC3=CN=CC=C3)OC

InChI

InChI=1S/C17H19BrN6O2/c1-3-24-17(21-22-23-24)20-10-13-7-14(18)16(15(8-13)25-2)26-11-12-5-4-6-19-9-12/h4-9H,3,10-11H2,1-2H3,(H,20,21,23)