4-(2-ethoxycarbonylpiperidin-1-yl)sulfonylbutanoic acid

Systemtic Name: 4-(2-ethoxycarbonylpiperidin-1-yl)sulfonylbutanoic acid Openeye Name: 4-[(2-ethoxycarbonyl-1-piperidyl)sulfonyl]butanoic acid CAS Name: 4-[(2-ethoxycarbonyl-1-piperidinyl)sulfonyl]butanoic acid IUPAC Name: 4-(2-ethoxycarbonylpiperidin-1-yl)sulfonylbutanoic acid Traditional Name: 4-(2-carbethoxypiperidino)sulfonylbutyric acid Formula: C12H21NO6S MolecularWeight: 307.36324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1S(=O)(=O)CCCC(=O)O

Isomeric SMILES

CCOC(=O)C1CCCCN1S(=O)(=O)CCCC(=O)O

InChI

InChI=1S/C12H21NO6S/c1-2-19-12(16)10-6-3-4-8-13(10)20(17,18)9-5-7-11(14)15/h10H,2-9H2,1H3,(H,14,15)