(2S)-3-(4-cyclopropylcarbonylpiperazin-1-yl)sulfonyl-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(4-cyclopropylcarbonylpiperazin-1-yl)sulfonyl-2-methyl-propanoic acid Openeye Name: (2S)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]sulfonyl-2-methyl-propanoic acid CAS Name: (2S)-3-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]sulfonyl]-2-methylpropanoic acid IUPAC Name: (2S)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]sulfonyl-2-methylpropanoic acid Traditional Name: (2S)-3-[4-(cyclopropanecarbonyl)piperazino]sulfonyl-2-methyl-propionic acid Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CCN(CC1)C(=O)C2CC2)C(=O)O

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CCN(CC1)C(=O)C2CC2)C(=O)O

InChI

InChI=1S/C12H20N2O5S/c1-9(12(16)17)8-20(18,19)14-6-4-13(5-7-14)11(15)10-2-3-10/h9-10H,2-8H2,1H3,(H,16,17)/t9-/m1/s1