2-[1-(1,3-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]ethanoate

Systemtic Name: 2-[1-(1,3-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]ethanoate Openeye Name: 2-[1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-piperidyl]acetate CAS Name: 2-[1-[(1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-piperidinyl]acetate IUPAC Name: 2-[1-(1,3-dimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]acetate Traditional Name: 2-[1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-piperidyl]acetate Formula: C12H18N3O4S- MolecularWeight: 300.35402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC(=O)[O-])C

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC(=O)[O-])C

InChI

InChI=1S/C12H19N3O4S/c1-9-11(8-14(2)13-9)20(18,19)15-5-3-10(4-6-15)7-12(16)17/h8,10H,3-7H2,1-2H3,(H,16,17)/p-1