[4-(2-chloranyl-4-nitro-phenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl] 4-chloranylbenzoate

Systemtic Name: [4-(2-chloranyl-4-nitro-phenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl] 4-chloranylbenzoate Openeye Name: [4-(2-chloro-4-nitro-benzoyl)-2,5-dimethyl-pyrazol-3-yl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(2-chloro-4-nitrophenyl)-oxomethyl]-2,5-dimethyl-3-pyrazolyl] ester IUPAC Name: [4-(2-chloro-4-nitrobenzoyl)-2,5-dimethylpyrazol-3-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-(2-chloro-4-nitro-benzoyl)-2,5-dimethyl-pyrazol-3-yl] ester Formula: C19H13Cl2N3O5 MolecularWeight: 434.22962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C19H13Cl2N3O5/c1-10-16(17(25)14-8-7-13(24(27)28)9-15(14)21)18(23(2)22-10)29-19(26)11-3-5-12(20)6-4-11/h3-9H,1-2H3