2-[2-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-4-oxo-1-(p-tolyl)azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-4-keto-1-(p-tolyl)azetidin-3-yl]isoindoline-1,3-quinone Formula: C25H18N2O5 MolecularWeight: 426.42082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(C2=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C25H18N2O5/c1-14-6-9-16(10-7-14)26-21(15-8-11-19-20(12-15)32-13-31-19)22(25(26)30)27-23(28)17-4-2-3-5-18(17)24(27)29/h2-12,21-22H,13H2,1H3