[3-(3-oxidanylidenebutanoylamino)phenyl] pentanoate

Systemtic Name: [3-(3-oxidanylidenebutanoylamino)phenyl] pentanoate Openeye Name: [3-(3-oxobutanoylamino)phenyl] pentanoate CAS Name: pentanoic acid [3-(1,3-dioxobutylamino)phenyl] ester IUPAC Name: [3-(3-oxobutanoylamino)phenyl] pentanoate Traditional Name: valeric acid [3-(acetoacetylamino)phenyl] ester Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=CC(=C1)NC(=O)CC(=O)C

Isomeric SMILES

CCCCC(=O)OC1=CC=CC(=C1)NC(=O)CC(=O)C

InChI

InChI=1S/C15H19NO4/c1-3-4-8-15(19)20-13-7-5-6-12(10-13)16-14(18)9-11(2)17/h5-7,10H,3-4,8-9H2,1-2H3,(H,16,18)