tert-butyl 3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]propanoate

Systemtic Name: tert-butyl 3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]propanoate Openeye Name: tert-butyl 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]propanoate CAS Name: 3-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]propanoate Traditional Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]propionic acid tert-butyl ester Formula: C12H20ClN3O4S MolecularWeight: 337.8229

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NCCC(=O)OC(C)(C)C)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NCCC(=O)OC(C)(C)C)Cl)C

InChI

InChI=1S/C12H20ClN3O4S/c1-8-10(11(13)16(5)15-8)21(18,19)14-7-6-9(17)20-12(2,3)4/h14H,6-7H2,1-5H3