(E)-7-(hydroxymethyl)-8-oxidanyl-8-pyridin-3-yl-oct-4-enoate

Systemtic Name: (E)-7-(hydroxymethyl)-8-oxidanyl-8-pyridin-3-yl-oct-4-enoate Openeye Name: (E)-8-hydroxy-7-(hydroxymethyl)-8-(3-pyridyl)oct-4-enoate CAS Name: (E)-8-hydroxy-7-(hydroxymethyl)-8-(3-pyridinyl)-4-octenoate IUPAC Name: (E)-8-hydroxy-7-(hydroxymethyl)-8-pyridin-3-yloct-4-enoate Traditional Name: (E)-8-hydroxy-7-methylol-8-(3-pyridyl)oct-4-enoate Formula: C14H18NO4- MolecularWeight: 264.29702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(C(CC=CCCC(=O)[O-])CO)O

Isomeric SMILES

C1=CC(=CN=C1)C(C(C/C=C/CCC(=O)[O-])CO)O

InChI

InChI=1S/C14H19NO4/c16-10-12(5-2-1-3-7-13(17)18)14(19)11-6-4-8-15-9-11/h1-2,4,6,8-9,12,14,16,19H,3,5,7,10H2,(H,17,18)/p-1/b2-1+