2-ethylsulfanyl-2-methyl-3-piperidin-1-ylcarbonyl-butanedioic acid

Systemtic Name: 2-ethylsulfanyl-2-methyl-3-piperidin-1-ylcarbonyl-butanedioic acid Openeye Name: 2-ethylsulfanyl-2-methyl-3-(piperidine-1-carbonyl)butanedioic acid CAS Name: 2-(ethylthio)-2-methyl-3-[oxo(1-piperidinyl)methyl]butanedioic acid IUPAC Name: 2-ethylsulfanyl-2-methyl-3-(piperidine-1-carbonyl)butanedioic acid Traditional Name: 2-(ethylthio)-2-methyl-3-(piperidine-1-carbonyl)succinic acid Formula: C13H21NO5S MolecularWeight: 303.37454

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)(C(C(=O)N1CCCCC1)C(=O)O)C(=O)O

Isomeric SMILES

CCSC(C)(C(C(=O)N1CCCCC1)C(=O)O)C(=O)O

InChI

InChI=1S/C13H21NO5S/c1-3-20-13(2,12(18)19)9(11(16)17)10(15)14-7-5-4-6-8-14/h9H,3-8H2,1-2H3,(H,16,17)(H,18,19)