2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]ethanoic acid

Systemtic Name: 2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]ethanoic acid Openeye Name: 2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]acetic acid CAS Name: 2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]acetic acid IUPAC Name: 2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]acetic acid Traditional Name: 2-[(4S,6S)-6-(cyanomethyl)-1,3-dioxan-4-yl]acetic acid Formula: C8H11NO4 MolecularWeight: 185.17724

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OCOC1CC(=O)O)CC#N

Isomeric SMILES

C1[C@@H](OCO[C@@H]1CC(=O)O)CC#N

InChI

InChI=1S/C8H11NO4/c9-2-1-6-3-7(4-8(10)11)13-5-12-6/h6-7H,1,3-5H2,(H,10,11)/t6-,7-/m0/s1