(4E)-1-[4-[2,3-bis(oxidanyl)propoxy]phenyl]-4-hydroxyimino-butan-1-one

Systemtic Name: (4E)-1-[4-[2,3-bis(oxidanyl)propoxy]phenyl]-4-hydroxyimino-butan-1-one Openeye Name: (1E)-4-[4-(2,3-dihydroxypropoxy)phenyl]-4-oxo-butanal oxime CAS Name: (1E)-4-[4-(2,3-dihydroxypropoxy)phenyl]-4-oxobutanal oxime IUPAC Name: (4E)-1-[4-(2,3-dihydroxypropoxy)phenyl]-4-hydroxyiminobutan-1-one Traditional Name: (1E)-4-(4-glyceryloxyphenyl)-4-keto-butyraldoxime Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC=NO)OCC(CO)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC/C=N/O)OCC(CO)O

InChI

InChI=1S/C13H17NO5/c15-8-11(16)9-19-12-5-3-10(4-6-12)13(17)2-1-7-14-18/h3-7,11,15-16,18H,1-2,8-9H2/b14-7+