3-[3-[(3,4-dichlorophenyl)carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[3-[(3,4-dichlorophenyl)carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[3-[(3,4-dichlorophenyl)carbamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[3-[(3,4-dichloroanilino)-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[3-[(3,4-dichlorophenyl)carbamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[3-[(3,4-dichlorophenyl)carbamoyl]pyrazol-1-yl]propionic acid Formula: C13H11Cl2N3O3 MolecularWeight: 328.15074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=NN(C=C2)CCC(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=NN(C=C2)CCC(=O)O)Cl)Cl

InChI

InChI=1S/C13H11Cl2N3O3/c14-9-2-1-8(7-10(9)15)16-13(21)11-3-5-18(17-11)6-4-12(19)20/h1-3,5,7H,4,6H2,(H,16,21)(H,19,20)