4-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)carbonylamino]butanoic acid

Systemtic Name: 4-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)carbonylamino]butanoic acid Openeye Name: 4-[(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)amino]butanoic acid CAS Name: 4-[[(5-chloro-1,3-dimethyl-4-pyrazolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(5-chloro-1,3-dimethylpyrazole-4-carbonyl)amino]butanoic acid Traditional Name: 4-[(5-chloro-1,3-dimethyl-pyrazole-4-carbonyl)amino]butyric acid Formula: C10H14ClN3O3 MolecularWeight: 259.68946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCC(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCC(=O)O)Cl)C

InChI

InChI=1S/C10H14ClN3O3/c1-6-8(9(11)14(2)13-6)10(17)12-5-3-4-7(15)16/h3-5H2,1-2H3,(H,12,17)(H,15,16)