2-[5-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: 2-[5-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]acetate CAS Name: 2-[5-(1,3-benzodioxol-5-yl)-2-tetrazolyl]acetate IUPAC Name: 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(1,3-benzodioxol-5-yl)tetrazol-2-yl]acetate Formula: C10H7N4O4- MolecularWeight: 247.18698

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN(N=N3)CC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN(N=N3)CC(=O)[O-]

InChI

InChI=1S/C10H8N4O4/c15-9(16)4-14-12-10(11-13-14)6-1-2-7-8(3-6)18-5-17-7/h1-3H,4-5H2,(H,15,16)/p-1