2-[4-(2-methylphenoxy)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[4-(2-methylphenoxy)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[4-(2-methylphenoxy)phenyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[4-(2-methylphenoxy)phenyl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[4-(2-methylphenoxy)phenyl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-[4-(2-methylphenoxy)phenyl]isoindoline-5-carboxylic acid Formula: C22H15NO5 MolecularWeight: 373.3582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O

InChI

InChI=1S/C22H15NO5/c1-13-4-2-3-5-19(13)28-16-9-7-15(8-10-16)23-20(24)17-11-6-14(22(26)27)12-18(17)21(23)25/h2-12H,1H3,(H,26,27)