2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-[4-(4-tert-amylphenoxy)phenyl]-1,3-diketo-isoindoline-5-carboxylate Formula: C26H22NO5- MolecularWeight: 428.45658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C26H23NO5/c1-4-26(2,3)17-6-10-19(11-7-17)32-20-12-8-18(9-13-20)27-23(28)21-14-5-16(25(30)31)15-22(21)24(27)29/h5-15H,4H2,1-3H3,(H,30,31)/p-1