2-(3-oxidanylidene-1-propan-2-yl-1H-isoindol-2-yl)butanedioic acid

Systemtic Name: 2-(3-oxidanylidene-1-propan-2-yl-1H-isoindol-2-yl)butanedioic acid Openeye Name: 2-(1-isopropyl-3-oxo-isoindolin-2-yl)butanedioic acid CAS Name: 2-(3-oxo-1-propan-2-yl-1H-isoindol-2-yl)butanedioic acid IUPAC Name: 2-(3-oxo-1-propan-2-yl-1H-isoindol-2-yl)butanedioic acid Traditional Name: 2-(1-isopropyl-3-keto-isoindolin-2-yl)succinic acid Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

InChI

InChI=1S/C15H17NO5/c1-8(2)13-9-5-3-4-6-10(9)14(19)16(13)11(15(20)21)7-12(17)18/h3-6,8,11,13H,7H2,1-2H3,(H,17,18)(H,20,21)