methyl 2-[5-(4-chloranyl-3-nitro-phenyl)-1,2,3,4-tetrazol-1-yl]ethanoate

Systemtic Name: methyl 2-[5-(4-chloranyl-3-nitro-phenyl)-1,2,3,4-tetrazol-1-yl]ethanoate Openeye Name: methyl 2-[5-(4-chloro-3-nitro-phenyl)tetrazol-1-yl]acetate CAS Name: 2-[5-(4-chloro-3-nitrophenyl)-1-tetrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(4-chloro-3-nitrophenyl)tetrazol-1-yl]acetate Traditional Name: 2-[5-(4-chloro-3-nitro-phenyl)tetrazol-1-yl]acetic acid methyl ester Formula: C10H8ClN5O4 MolecularWeight: 297.65462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=NN=N1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CN1C(=NN=N1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H8ClN5O4/c1-20-9(17)5-15-10(12-13-14-15)6-2-3-7(11)8(4-6)16(18)19/h2-4H,5H2,1H3