2-[2-(2-diethylaminoethyl)-3-oxidanylidene-1H-isoindol-1-yl]benzoic acid

Systemtic Name: 2-[2-(2-diethylaminoethyl)-3-oxidanylidene-1H-isoindol-1-yl]benzoic acid Openeye Name: 2-[2-(2-diethylaminoethyl)-3-oxo-isoindolin-1-yl]benzoic acid CAS Name: 2-[2-(2-diethylaminoethyl)-3-oxo-1H-isoindol-1-yl]benzoic acid IUPAC Name: 2-[2-(2-diethylaminoethyl)-3-oxo-1H-isoindol-1-yl]benzoic acid Traditional Name: 2-[2-(2-diethylaminoethyl)-3-keto-isoindolin-1-yl]benzoic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCN(CC)CCN1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H24N2O3/c1-3-22(4-2)13-14-23-19(15-9-5-7-11-17(15)20(23)24)16-10-6-8-12-18(16)21(25)26/h5-12,19H,3-4,13-14H2,1-2H3,(H,25,26)