2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]piperidin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]piperidin-1-yl]carbonylbenzoic acid Openeye Name: 2-[3-(1,3-dioxoisoindolin-2-yl)piperidine-1-carbonyl]benzoic acid CAS Name: 2-[[3-(1,3-dioxo-2-isoindolyl)-1-piperidinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[3-(1,3-dioxoisoindol-2-yl)piperidine-1-carbonyl]benzoic acid Traditional Name: 2-(3-phthalimidopiperidine-1-carbonyl)benzoic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2C(=O)O)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2C(=O)O)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18N2O5/c24-18(16-9-3-4-10-17(16)21(27)28)22-11-5-6-13(12-22)23-19(25)14-7-1-2-8-15(14)20(23)26/h1-4,7-10,13H,5-6,11-12H2,(H,27,28)