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

Systemtic Name: 2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)butanedioic acid Openeye Name: 2-(4-methyl-1-oxo-isoindolin-2-yl)butanedioic acid CAS Name: 2-(7-methyl-3-oxo-1H-isoindol-2-yl)butanedioic acid IUPAC Name: 2-(7-methyl-3-oxo-1H-isoindol-2-yl)butanedioic acid Traditional Name: 2-(1-keto-4-methyl-isoindolin-2-yl)succinic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CN(C2=O)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC2=C1CN(C2=O)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C13H13NO5/c1-7-3-2-4-8-9(7)6-14(12(8)17)10(13(18)19)5-11(15)16/h2-4,10H,5-6H2,1H3,(H,15,16)(H,18,19)