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

Systemtic Name: ethyl 2-[5-(4-chloranyl-2-nitro-phenyl)-3-methyl-pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[5-(4-chloro-2-nitro-phenyl)-3-methyl-pyrazol-1-yl]acetate CAS Name: 2-[5-(4-chloro-2-nitrophenyl)-3-methyl-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-chloro-2-nitrophenyl)-3-methylpyrazol-1-yl]acetate Traditional Name: 2-[5-(4-chloro-2-nitro-phenyl)-3-methyl-pyrazol-1-yl]acetic acid ethyl ester Formula: C14H14ClN3O4 MolecularWeight: 323.73166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClN3O4/c1-3-22-14(19)8-17-12(6-9(2)16-17)11-5-4-10(15)7-13(11)18(20)21/h4-7H,3,8H2,1-2H3