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

Systemtic Name: 2-[2-(4-butoxyphenyl)-1-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-azetidin-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-(4-butoxyphenyl)-1-(3-chloro-4-methoxy-phenyl)-4-oxo-azetidin-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(4-butoxyphenyl)-1-(3-chloro-4-methoxyphenyl)-4-oxo-3-azetidinyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-butoxyphenyl)-1-(3-chloro-4-methoxyphenyl)-4-oxoazetidin-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(4-butoxyphenyl)-1-(3-chloro-4-methoxy-phenyl)-4-keto-azetidin-3-yl]isoindoline-1,3-quinone Formula: C28H25ClN2O5 MolecularWeight: 504.9615

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25ClN2O5/c1-3-4-15-36-19-12-9-17(10-13-19)24-25(31-26(32)20-7-5-6-8-21(20)27(31)33)28(34)30(24)18-11-14-23(35-2)22(29)16-18/h5-14,16,24-25H,3-4,15H2,1-2H3