2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]benzoic acid

Systemtic Name: 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]benzoic acid Openeye Name: 2-[4-(1,3-dioxoisoindolin-2-yl)butanoylamino]benzoic acid CAS Name: 2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]benzoic acid IUPAC Name: 2-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]benzoic acid Traditional Name: 2-(4-phthalimidobutanoylamino)benzoic acid Formula: C19H16N2O5 MolecularWeight: 352.34074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H16N2O5/c22-16(20-15-9-4-3-8-14(15)19(25)26)10-5-11-21-17(23)12-6-1-2-7-13(12)18(21)24/h1-4,6-9H,5,10-11H2,(H,20,22)(H,25,26)