ethyl 2-methyl-2-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]propanoate

Systemtic Name: ethyl 2-methyl-2-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]propanoate Openeye Name: ethyl 2-methyl-2-[5-(4-nitrophenyl)tetrazol-2-yl]propanoate CAS Name: 2-methyl-2-[5-(4-nitrophenyl)-2-tetrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-2-[5-(4-nitrophenyl)tetrazol-2-yl]propanoate Traditional Name: 2-methyl-2-[5-(4-nitrophenyl)tetrazol-2-yl]propionic acid ethyl ester Formula: C13H15N5O4 MolecularWeight: 305.2893

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)N1N=C(N=N1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)(C)N1N=C(N=N1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O4/c1-4-22-12(19)13(2,3)18-15-11(14-16-18)9-5-7-10(8-6-9)17(20)21/h5-8H,4H2,1-3H3