diethyl 5-nitro-6-phenyl-2-(1,2,3,4-tetrazol-1-yl)pyridine-3,4-dicarboxylate

Systemtic Name: diethyl 5-nitro-6-phenyl-2-(1,2,3,4-tetrazol-1-yl)pyridine-3,4-dicarboxylate Openeye Name: diethyl 5-nitro-6-phenyl-2-(tetrazol-1-yl)pyridine-3,4-dicarboxylate CAS Name: 5-nitro-6-phenyl-2-(1-tetrazolyl)pyridine-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-nitro-6-phenyl-2-(tetrazol-1-yl)pyridine-3,4-dicarboxylate Traditional Name: 5-nitro-6-phenyl-2-(tetrazol-1-yl)pyridine-3,4-dicarboxylic acid diethyl ester Formula: C18H16N6O6 MolecularWeight: 412.35624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NC(=C1[N+](=O)[O-])C2=CC=CC=C2)N3C=NN=N3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=NC(=C1[N+](=O)[O-])C2=CC=CC=C2)N3C=NN=N3)C(=O)OCC

InChI

InChI=1S/C18H16N6O6/c1-3-29-17(25)12-13(18(26)30-4-2)16(23-10-19-21-22-23)20-14(15(12)24(27)28)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3