(2S)-1-[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[4-(4-oxo-1-piperidyl)phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[4-(4-oxo-1-piperidinyl)phenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[4-(4-oxopiperidin-1-yl)phenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[4-(4-ketopiperidino)phenyl]sulfonylproline Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCC(=O)CC3)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=C(C=C2)N3CCC(=O)CC3)C(=O)O

InChI

InChI=1S/C16H20N2O5S/c19-13-7-10-17(11-8-13)12-3-5-14(6-4-12)24(22,23)18-9-1-2-15(18)16(20)21/h3-6,15H,1-2,7-11H2,(H,20,21)/t15-/m0/s1