(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 5-nitrofuran-2-carboxylate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 5-nitrofuran-2-carboxylate Openeye Name: (1-phenyltetrazol-5-yl)methyl 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C13H9N5O5 MolecularWeight: 315.24106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O5/c19-13(10-6-7-12(23-10)18(20)21)22-8-11-14-15-16-17(11)9-4-2-1-3-5-9/h1-7H,8H2