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

Systemtic Name: 2-(1-butyl-3-oxidanylidene-1H-isoindol-2-yl)butanedioic acid Openeye Name: 2-(1-butyl-3-oxo-isoindolin-2-yl)butanedioic acid CAS Name: 2-(1-butyl-3-oxo-1H-isoindol-2-yl)butanedioic acid IUPAC Name: 2-(1-butyl-3-oxo-1H-isoindol-2-yl)butanedioic acid Traditional Name: 2-(1-butyl-3-keto-isoindolin-2-yl)succinic acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCC1C2=CC=CC=C2C(=O)N1C(CC(=O)O)C(=O)O

InChI

InChI=1S/C16H19NO5/c1-2-3-8-12-10-6-4-5-7-11(10)15(20)17(12)13(16(21)22)9-14(18)19/h4-7,12-13H,2-3,8-9H2,1H3,(H,18,19)(H,21,22)