[3-(3-oxidanylidenebutanoylamino)phenyl]phosphonic acid

Systemtic Name: [3-(3-oxidanylidenebutanoylamino)phenyl]phosphonic acid Openeye Name: [3-(3-oxobutanoylamino)phenyl]phosphonic acid CAS Name: [3-(1,3-dioxobutylamino)phenyl]phosphonic acid IUPAC Name: [3-(3-oxobutanoylamino)phenyl]phosphonic acid Traditional Name: [3-(acetoacetylamino)phenyl]phosphonic acid Formula: C10H12NO5P MolecularWeight: 257.179741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC1=CC(=CC=C1)P(=O)(O)O

Isomeric SMILES

CC(=O)CC(=O)NC1=CC(=CC=C1)P(=O)(O)O

InChI

InChI=1S/C10H12NO5P/c1-7(12)5-10(13)11-8-3-2-4-9(6-8)17(14,15)16/h2-4,6H,5H2,1H3,(H,11,13)(H2,14,15,16)