1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-ethyl]-4-oxidanyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-ethyl]-4-oxidanyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-ethyl]-4-hydroxy-piperidine-4-carboxylic acid CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxyethyl]-4-hydroxy-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxyethyl]-4-hydroxypiperidine-4-carboxylic acid Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-ethyl]-4-hydroxy-isonipecotic acid Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)O)O)CC(C2=CC3=C(C=C2)OCCO3)O

Isomeric SMILES

C1CN(CCC1(C(=O)O)O)CC(C2=CC3=C(C=C2)OCCO3)O

InChI

InChI=1S/C16H21NO6/c18-12(10-17-5-3-16(21,4-6-17)15(19)20)11-1-2-13-14(9-11)23-8-7-22-13/h1-2,9,12,18,21H,3-8,10H2,(H,19,20)