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2-[4-[2-(hydroxymethyl)-6-oxidanylidene-piperidin-1-yl]but-2-ynoxy]ethanoic acid

2-[4-[2-(hydroxymethyl)-6-oxidanylidene-piperidin-1-yl]but-2-ynoxy]ethanoic acid

Systemtic Name:2-[4-[2-(hydroxymethyl)-6-oxidanylidene-piperidin-1-yl]but-2-ynoxy]ethanoic acid
Openeye Name:2-[4-[2-(hydroxymethyl)-6-oxo-1-piperidyl]but-2-ynoxy]acetic acid
CAS Name:2-[4-[2-(hydroxymethyl)-6-oxo-1-piperidinyl]but-2-ynoxy]acetic acid
IUPAC Name:2-[4-[2-(hydroxymethyl)-6-oxopiperidin-1-yl]but-2-ynoxy]acetic acid
Traditional Name:2-[4-(2-keto-6-methylol-piperidino)but-2-ynoxy]acetic acid
Formula: C12H17NO5
MolecularWeight: 255.26708
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C(=O)C1)CC#CCOCC(=O)O)CO


Isomeric SMILES

C1CC(N(C(=O)C1)CC#CCOCC(=O)O)CO


InChI

InChI=1S/C12H17NO5/c14-8-10-4-3-5-11(15)13(10)6-1-2-7-18-9-12(16)17/h10,14H,3-9H2,(H,16,17)


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