1-[[3,4-bis(chloranyl)phenoxy]methyl]-4-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 1-[[3,4-bis(chloranyl)phenoxy]methyl]-4-nitro-pyrazole-3-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid CAS Name: 1-[(3,4-dichlorophenoxy)methyl]-4-nitro-3-pyrazolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenoxy)methyl]-4-nitropyrazole-3-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenoxy)methyl]-4-nitro-pyrazole-3-carboxylic acid Formula: C11H7Cl2N3O5 MolecularWeight: 332.09638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCN2C=C(C(=N2)C(=O)O)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1OCN2C=C(C(=N2)C(=O)O)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C11H7Cl2N3O5/c12-7-2-1-6(3-8(7)13)21-5-15-4-9(16(19)20)10(14-15)11(17)18/h1-4H,5H2,(H,17,18)