2-[4-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propylcarbamoyl]pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[3-(4-chloranyl-3-methyl-pyrazol-1-yl)propylcarbamoyl]pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-[3-(4-chloro-3-methyl-pyrazol-1-yl)propylcarbamoyl]pyrazol-1-yl]acetic acid CAS Name: 2-[4-[[3-(4-chloro-3-methyl-1-pyrazolyl)propylamino]-oxomethyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-[3-(4-chloro-3-methylpyrazol-1-yl)propylcarbamoyl]pyrazol-1-yl]acetic acid Traditional Name: 2-[4-[3-(4-chloro-3-methyl-pyrazol-1-yl)propylcarbamoyl]pyrazol-1-yl]acetic acid Formula: C13H16ClN5O3 MolecularWeight: 325.75084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Cl)CCCNC(=O)C2=CN(N=C2)CC(=O)O

Isomeric SMILES

CC1=NN(C=C1Cl)CCCNC(=O)C2=CN(N=C2)CC(=O)O

InChI

InChI=1S/C13H16ClN5O3/c1-9-11(14)7-18(17-9)4-2-3-15-13(22)10-5-16-19(6-10)8-12(20)21/h5-7H,2-4,8H2,1H3,(H,15,22)(H,20,21)