(3Z)-3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-[(4-methoxyphenyl)methyl]-4-phenylmethoxy-isoindol-1-one

Systemtic Name: (3Z)-3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-2-[(4-methoxyphenyl)methyl]-4-phenylmethoxy-isoindol-1-one Openeye Name: (3Z)-4-benzyloxy-3-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-2-[(4-methoxyphenyl)methyl]isoindolin-1-one CAS Name: (3Z)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-[(4-methoxyphenyl)methyl]-4-phenylmethoxy-1-isoindolone IUPAC Name: (3Z)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-[(4-methoxyphenyl)methyl]-4-phenylmethoxyisoindol-1-one Traditional Name: (3Z)-4-benzoxy-3-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-2-p-anisyl-isoindolin-1-one Formula: C31H24BrNO5 MolecularWeight: 570.42996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=CC3=CC4=C(C=C3Br)OCO4)C5=C(C2=O)C=CC=C5OCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)CN2/C(=C\C3=CC4=C(C=C3Br)OCO4)/C5=C(C2=O)C=CC=C5OCC6=CC=CC=C6

InChI

InChI=1S/C31H24BrNO5/c1-35-23-12-10-20(11-13-23)17-33-26(14-22-15-28-29(16-25(22)32)38-19-37-28)30-24(31(33)34)8-5-9-27(30)36-18-21-6-3-2-4-7-21/h2-16H,17-19H2,1H3/b26-14-