2-[1,3-bis(oxidanylidene)-4-propyl-isoindol-2-yl]butanedioic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)-4-propyl-isoindol-2-yl]butanedioic acid Openeye Name: 2-(1,3-dioxo-4-propyl-isoindolin-2-yl)butanedioic acid CAS Name: 2-(1,3-dioxo-4-propyl-2-isoindolyl)butanedioic acid IUPAC Name: 2-(1,3-dioxo-4-propylisoindol-2-yl)butanedioic acid Traditional Name: 2-(1,3-diketo-4-propyl-isoindolin-2-yl)succinic acid Formula: C15H15NO6 MolecularWeight: 305.2827

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1C(=O)N(C2=O)C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCC1=CC=CC2=C1C(=O)N(C2=O)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C15H15NO6/c1-2-4-8-5-3-6-9-12(8)14(20)16(13(9)19)10(15(21)22)7-11(17)18/h3,5-6,10H,2,4,7H2,1H3,(H,17,18)(H,21,22)