[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl] 3-benzamidobutanoate

Systemtic Name: [2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl] 3-benzamidobutanoate Openeye Name: [2-(2,4-dihydroxyphenyl)-2-oxo-ethyl] 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [2-(2,4-dihydroxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dihydroxyphenyl)-2-oxoethyl] 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-(2,4-dihydroxyphenyl)-2-keto-ethyl] ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)C1=C(C=C(C=C1)O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OCC(=O)C1=C(C=C(C=C1)O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H19NO6/c1-12(20-19(25)13-5-3-2-4-6-13)9-18(24)26-11-17(23)15-8-7-14(21)10-16(15)22/h2-8,10,12,21-22H,9,11H2,1H3,(H,20,25)