(2S)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)propanoate

Systemtic Name: (2S)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)propanoate Openeye Name: (2S)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]propanoate CAS Name: (2S)-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)propanoate IUPAC Name: (2S)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)propanoate Traditional Name: (2S)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]propionate Formula: C11H16N2O4S2 MolecularWeight: 304.38574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C11H16N2O4S2/c1-9(11(14)15)12-4-6-13(7-5-12)19(16,17)10-3-2-8-18-10/h2-3,8-9H,4-7H2,1H3,(H,14,15)/t9-/m0/s1