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

Systemtic Name: 2-[2-(4-butoxyphenyl)-1-(4-methylphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(4-butoxyphenyl)-4-oxo-1-(p-tolyl)azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(4-butoxyphenyl)-1-(4-methylphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-butoxyphenyl)-1-(4-methylphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(4-butoxyphenyl)-4-keto-1-(p-tolyl)azetidin-3-yl]isoindoline-1,3-quinone Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H26N2O4/c1-3-4-17-34-21-15-11-19(12-16-21)24-25(28(33)29(24)20-13-9-18(2)10-14-20)30-26(31)22-7-5-6-8-23(22)27(30)32/h5-16,24-25H,3-4,17H2,1-2H3