2-(1,3-benzodioxol-4-ylmethyl)-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(1,3-benzodioxol-4-ylmethyl)-4-(1,3-dihydroisoindol-2-yl)-4-oxidanylidene-butanoic acid Openeye Name: 2-(1,3-benzodioxol-4-ylmethyl)-4-isoindolin-2-yl-4-oxo-butanoic acid CAS Name: 2-(1,3-benzodioxol-4-ylmethyl)-4-(1,3-dihydroisoindol-2-yl)-4-oxobutanoic acid IUPAC Name: 2-(1,3-benzodioxol-4-ylmethyl)-4-(1,3-dihydroisoindol-2-yl)-4-oxobutanoic acid Traditional Name: 2-(1,3-benzodioxol-4-ylmethyl)-4-isoindolin-2-yl-4-keto-butyric acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C(=O)CC(CC3=C4C(=CC=C3)OCO4)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2CN1C(=O)CC(CC3=C4C(=CC=C3)OCO4)C(=O)O

InChI

InChI=1S/C20H19NO5/c22-18(21-10-14-4-1-2-5-15(14)11-21)9-16(20(23)24)8-13-6-3-7-17-19(13)26-12-25-17/h1-7,16H,8-12H2,(H,23,24)