2-[(2R)-3-(4-hydroxyphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[(2R)-3-(4-hydroxyphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[(1R)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[(2R)-1-hydroxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[(2R)-1-hydroxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-[(1R)-2-hydroxy-1-(4-hydroxybenzyl)-2-keto-ethyl]-1,3-diketo-isoindoline-5-carboxylic acid Formula: C18H13NO7 MolecularWeight: 355.29832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1C[C@H](C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)O

InChI

InChI=1S/C18H13NO7/c20-11-4-1-9(2-5-11)7-14(18(25)26)19-15(21)12-6-3-10(17(23)24)8-13(12)16(19)22/h1-6,8,14,20H,7H2,(H,23,24)(H,25,26)/t14-/m1/s1