2-[(2R)-3-(2-methylphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[(2R)-3-(2-methylphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[(1R)-2-hydroxy-1-(o-tolylmethyl)-2-oxo-ethyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[(2R)-1-hydroxy-3-(2-methylphenyl)-1-oxopropan-2-yl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[(2R)-1-hydroxy-3-(2-methylphenyl)-1-oxopropan-2-yl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-[(1R)-2-hydroxy-2-keto-1-(2-methylbenzyl)ethyl]-1,3-diketo-isoindoline-5-carboxylic acid Formula: C19H15NO6 MolecularWeight: 353.3255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C[C@H](C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O

InChI

InChI=1S/C19H15NO6/c1-10-4-2-3-5-11(10)9-15(19(25)26)20-16(21)13-7-6-12(18(23)24)8-14(13)17(20)22/h2-8,15H,9H2,1H3,(H,23,24)(H,25,26)/t15-/m1/s1