2-[(2,4-dichlorophenyl)methyl]-5-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 2-[(2,4-dichlorophenyl)methyl]-5-nitro-pyrazole-3-carboxylic acid Openeye Name: 2-[(2,4-dichlorophenyl)methyl]-5-nitro-pyrazole-3-carboxylic acid CAS Name: 2-[(2,4-dichlorophenyl)methyl]-5-nitro-3-pyrazolecarboxylic acid IUPAC Name: 2-[(2,4-dichlorophenyl)methyl]-5-nitropyrazole-3-carboxylic acid Traditional Name: 2-(2,4-dichlorobenzyl)-5-nitro-pyrazole-3-carboxylic acid Formula: C11H7Cl2N3O4 MolecularWeight: 316.09698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H7Cl2N3O4/c12-7-2-1-6(8(13)3-7)5-15-9(11(17)18)4-10(14-15)16(19)20/h1-4H,5H2,(H,17,18)