[3-(3-oxidanylidenebutanoylamino)phenyl] ethanoate

Systemtic Name: [3-(3-oxidanylidenebutanoylamino)phenyl] ethanoate Openeye Name: [3-(3-oxobutanoylamino)phenyl] acetate CAS Name: acetic acid [3-(1,3-dioxobutylamino)phenyl] ester IUPAC Name: [3-(3-oxobutanoylamino)phenyl] acetate Traditional Name: acetic acid [3-(acetoacetylamino)phenyl] ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-8(14)6-12(16)13-10-4-3-5-11(7-10)17-9(2)15/h3-5,7H,6H2,1-2H3,(H,13,16)