3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid

Systemtic Name: 3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(4-fluorophenyl)propionic acid Formula: C14H15ClFN3O4S MolecularWeight: 375.803003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NC(CC(=O)O)C2=CC=C(C=C2)F)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NC(CC(=O)O)C2=CC=C(C=C2)F)Cl)C

InChI

InChI=1S/C14H15ClFN3O4S/c1-8-13(14(15)19(2)17-8)24(22,23)18-11(7-12(20)21)9-3-5-10(16)6-4-9/h3-6,11,18H,7H2,1-2H3,(H,20,21)