5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazole

Systemtic Name: 5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-(oxolan-2-ylmethyl)-1,2,3,4-tetrazole Openeye Name: 5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-(tetrahydrofuran-2-ylmethyl)tetrazole CAS Name: 5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-1-(2-oxolanylmethyl)tetrazole IUPAC Name: 5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-(oxolan-2-ylmethyl)tetrazole Traditional Name: 5-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-1-(tetrahydrofurfuryl)tetrazole Formula: C15H17N5O5S MolecularWeight: 379.39098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=N2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1CC(OC1)CN2C(=NN=N2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C15H17N5O5S/c21-20(22)12-4-10-7-23-9-25-14(10)11(5-12)8-26-15-16-17-18-19(15)6-13-2-1-3-24-13/h4-5,13H,1-3,6-9H2