2-(4,5-dimethoxy-2-nitro-phenyl)propyl 1,2,3,4-tetrazole-1-carboxylate

Systemtic Name: 2-(4,5-dimethoxy-2-nitro-phenyl)propyl 1,2,3,4-tetrazole-1-carboxylate Openeye Name: 2-(4,5-dimethoxy-2-nitro-phenyl)propyl tetrazole-1-carboxylate CAS Name: 1-tetrazolecarboxylic acid 2-(4,5-dimethoxy-2-nitrophenyl)propyl ester IUPAC Name: 2-(4,5-dimethoxy-2-nitrophenyl)propyl tetrazole-1-carboxylate Traditional Name: tetrazole-1-carboxylic acid 2-(4,5-dimethoxy-2-nitro-phenyl)propyl ester Formula: C13H15N5O6 MolecularWeight: 337.2881

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)N1C=NN=N1)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(COC(=O)N1C=NN=N1)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C13H15N5O6/c1-8(6-24-13(19)17-7-14-15-16-17)9-4-11(22-2)12(23-3)5-10(9)18(20)21/h4-5,7-8H,6H2,1-3H3