(3S)-1-[3-(diethylamino)-3-oxidanylidene-propyl]sulfonylpiperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[3-(diethylamino)-3-oxidanylidene-propyl]sulfonylpiperidine-3-carboxylic acid Openeye Name: (3S)-1-[3-(diethylamino)-3-oxo-propyl]sulfonylpiperidine-3-carboxylic acid CAS Name: (3S)-1-[3-(diethylamino)-3-oxopropyl]sulfonyl-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[3-(diethylamino)-3-oxopropyl]sulfonylpiperidine-3-carboxylic acid Traditional Name: (3S)-1-[3-(diethylamino)-3-keto-propyl]sulfonylnipecotic acid Formula: C13H24N2O5S MolecularWeight: 320.40506

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCS(=O)(=O)N1CCCC(C1)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)CCS(=O)(=O)N1CCC[C@@H](C1)C(=O)O

InChI

InChI=1S/C13H24N2O5S/c1-3-14(4-2)12(16)7-9-21(19,20)15-8-5-6-11(10-15)13(17)18/h11H,3-10H2,1-2H3,(H,17,18)/t11-/m0/s1