2-(3-oxidanylidene-7-propan-2-yl-1H-isoindol-2-yl)butanedioic acid

Systemtic Name: 2-(3-oxidanylidene-7-propan-2-yl-1H-isoindol-2-yl)butanedioic acid Openeye Name: 2-(4-isopropyl-1-oxo-isoindolin-2-yl)butanedioic acid CAS Name: 2-(3-oxo-7-propan-2-yl-1H-isoindol-2-yl)butanedioic acid IUPAC Name: 2-(3-oxo-7-propan-2-yl-1H-isoindol-2-yl)butanedioic acid Traditional Name: 2-(4-isopropyl-1-keto-isoindolin-2-yl)succinic acid Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C1CN(C2=O)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC2=C1CN(C2=O)C(CC(=O)O)C(=O)O

InChI

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