5-chloranyl-3-ethyl-1-(3-nitrophenyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-3-ethyl-1-(3-nitrophenyl)pyrazole-4-carboxylic acid Openeye Name: 5-chloro-3-ethyl-1-(3-nitrophenyl)pyrazole-4-carboxylic acid CAS Name: 5-chloro-3-ethyl-1-(3-nitrophenyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-3-ethyl-1-(3-nitrophenyl)pyrazole-4-carboxylic acid Traditional Name: 5-chloro-3-ethyl-1-(3-nitrophenyl)pyrazole-4-carboxylic acid Formula: C12H10ClN3O4 MolecularWeight: 295.6785

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)O)Cl)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN(C(=C1C(=O)O)Cl)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10ClN3O4/c1-2-9-10(12(17)18)11(13)15(14-9)7-4-3-5-8(6-7)16(19)20/h3-6H,2H2,1H3,(H,17,18)