1-[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]piperidine-2-carboxylic acid Openeye Name: 1-[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]piperidine-2-carboxylic acid CAS Name: 1-[2-(mercaptomethyl)-4-methoxy-1,4-dioxobutyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]piperidine-2-carboxylic acid Traditional Name: 1-[4-keto-2-(mercaptomethyl)-4-methoxy-butanoyl]pipecolinic acid Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CS)C(=O)N1CCCCC1C(=O)O

Isomeric SMILES

COC(=O)CC(CS)C(=O)N1CCCCC1C(=O)O

InChI

InChI=1S/C12H19NO5S/c1-18-10(14)6-8(7-19)11(15)13-5-3-2-4-9(13)12(16)17/h8-9,19H,2-7H2,1H3,(H,16,17)