2-[2-(4-dimethylaminophenyl)-1-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-dimethylaminophenyl)-1-(4-ethoxyphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(4-dimethylaminophenyl)-1-(4-ethoxyphenyl)-4-oxo-azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(4-dimethylaminophenyl)-1-(4-ethoxyphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-dimethylaminophenyl)-1-(4-ethoxyphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(4-dimethylaminophenyl)-4-keto-1-p-phenetyl-azetidin-3-yl]isoindoline-1,3-quinone Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C27H25N3O4/c1-4-34-20-15-13-19(14-16-20)29-23(17-9-11-18(12-10-17)28(2)3)24(27(29)33)30-25(31)21-7-5-6-8-22(21)26(30)32/h5-16,23-24H,4H2,1-3H3