(2S)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2-methyl-propanoate

Systemtic Name: (2S)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2-methyl-propanoate Openeye Name: (2S)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2-methyl-propanoate CAS Name: (2S)-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-2-methylpropanoate IUPAC Name: (2S)-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-2-methylpropanoate Traditional Name: (2S)-3-[4-(4-fluorophenyl)piperazino]sulfonyl-2-methyl-propionate Formula: C14H18FN2O4S- MolecularWeight: 329.367123

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)F)C(=O)[O-]

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)F)C(=O)[O-]

InChI

InChI=1S/C14H19FN2O4S/c1-11(14(18)19)10-22(20,21)17-8-6-16(7-9-17)13-4-2-12(15)3-5-13/h2-5,11H,6-10H2,1H3,(H,18,19)/p-1/t11-/m1/s1