4-[5-(3-nitrophenoxy)-1,2,3,4-tetrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-(3-nitrophenoxy)-1,2,3,4-tetrazol-1-yl]benzoic acid Openeye Name: 4-[5-(3-nitrophenoxy)tetrazol-1-yl]benzoic acid CAS Name: 4-[5-(3-nitrophenoxy)-1-tetrazolyl]benzoic acid IUPAC Name: 4-[5-(3-nitrophenoxy)tetrazol-1-yl]benzoic acid Traditional Name: 4-[5-(3-nitrophenoxy)tetrazol-1-yl]benzoic acid Formula: C14H9N5O5 MolecularWeight: 327.25176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H9N5O5/c20-13(21)9-4-6-10(7-5-9)18-14(15-16-17-18)24-12-3-1-2-11(8-12)19(22)23/h1-8H,(H,20,21)