sodium 2-[2,5-bis(chloranyl)-4-pyrazol-1-yl-phenyl]propanoate

Systemtic Name: sodium 2-[2,5-bis(chloranyl)-4-pyrazol-1-yl-phenyl]propanoate Openeye Name: sodium 2-(2,5-dichloro-4-pyrazol-1-yl-phenyl)propanoate CAS Name: sodium 2-[2,5-dichloro-4-(1-pyrazolyl)phenyl]propanoate IUPAC Name: sodium 2-(2,5-dichloro-4-pyrazol-1-ylphenyl)propanoate Traditional Name: sodium 2-(2,5-dichloro-4-pyrazol-1-yl-phenyl)propionate Formula: C12H9Cl2N2NaO2 MolecularWeight: 307.10783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1Cl)N2C=CC=N2)Cl)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C1=CC(=C(C=C1Cl)N2C=CC=N2)Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H10Cl2N2O2.Na/c1-7(12(17)18)8-5-10(14)11(6-9(8)13)16-4-2-3-15-16;/h2-7H,1H3,(H,17,18);/q;+1/p-1