ethyl 2-(2-butyl-1-oxidanyl-3-oxidanylidene-isoindol-1-yl)ethanoate

Systemtic Name: ethyl 2-(2-butyl-1-oxidanyl-3-oxidanylidene-isoindol-1-yl)ethanoate Openeye Name: ethyl 2-(2-butyl-1-hydroxy-3-oxo-isoindolin-1-yl)acetate CAS Name: 2-(2-butyl-1-hydroxy-3-oxo-1-isoindolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-butyl-1-hydroxy-3-oxoisoindol-1-yl)acetate Traditional Name: 2-(2-butyl-1-hydroxy-3-keto-isoindolin-1-yl)acetic acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C1(CC(=O)OCC)O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C1(CC(=O)OCC)O

InChI

InChI=1S/C16H21NO4/c1-3-5-10-17-15(19)12-8-6-7-9-13(12)16(17,20)11-14(18)21-4-2/h6-9,20H,3-5,10-11H2,1-2H3