ethyl 4-acetamido-3-[2,3-bis(oxidanyl)propyl]benzoate

Systemtic Name: ethyl 4-acetamido-3-[2,3-bis(oxidanyl)propyl]benzoate Openeye Name: ethyl 4-acetamido-3-(2,3-dihydroxypropyl)benzoate CAS Name: 4-acetamido-3-(2,3-dihydroxypropyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-acetamido-3-(2,3-dihydroxypropyl)benzoate Traditional Name: 4-acetamido-3-glyceryl-benzoic acid ethyl ester Formula: C14H19NO5 MolecularWeight: 281.30436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C)CC(CO)O

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C)CC(CO)O

InChI

InChI=1S/C14H19NO5/c1-3-20-14(19)10-4-5-13(15-9(2)17)11(6-10)7-12(18)8-16/h4-6,12,16,18H,3,7-8H2,1-2H3,(H,15,17)