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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

InChI

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