[4-(3-oxidanylidenebutanoylamino)phenyl] hydrogen carbonate

Systemtic Name: [4-(3-oxidanylidenebutanoylamino)phenyl] hydrogen carbonate Openeye Name: [4-(3-oxobutanoylamino)phenyl] hydrogen carbonate CAS Name: carbonic acid [4-(1,3-dioxobutylamino)phenyl] ester IUPAC Name: [4-(3-oxobutanoylamino)phenyl] hydrogen carbonate Traditional Name: carbonic acid [4-(acetoacetylamino)phenyl] ester Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NC1=CC=C(C=C1)OC(=O)O

Isomeric SMILES

CC(=O)CC(=O)NC1=CC=C(C=C1)OC(=O)O

InChI

InChI=1S/C11H11NO5/c1-7(13)6-10(14)12-8-2-4-9(5-3-8)17-11(15)16/h2-5H,6H2,1H3,(H,12,14)(H,15,16)