2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-oxo-azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(4-butoxyphenyl)-1-(2,4-dimethoxyphenyl)-4-keto-azetidin-3-yl]isoindoline-1,3-quinone Formula: C29H28N2O6 MolecularWeight: 500.54242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=O)N2C3=C(C=C(C=C3)OC)OC)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(C(=O)N2C3=C(C=C(C=C3)OC)OC)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C29H28N2O6/c1-4-5-16-37-19-12-10-18(11-13-19)25-26(31-27(32)21-8-6-7-9-22(21)28(31)33)29(34)30(25)23-15-14-20(35-2)17-24(23)36-3/h6-15,17,25-26H,4-5,16H2,1-3H3