[3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate

Systemtic Name: [3-(2-bromanylphenoxy)-4-oxidanylidene-chromen-7-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate Openeye Name: [3-(2-bromophenoxy)-4-oxo-chromen-7-yl] 2-benzyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxylic acid [3-(2-bromophenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-bromophenoxy)-4-oxochromen-7-yl] 2-benzyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-benzyl-1,3-diketo-isoindoline-5-carboxylic acid [3-(2-bromophenoxy)-4-keto-chromen-7-yl] ester Formula: C31H18BrNO7 MolecularWeight: 596.38112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC5=C(C=C4)C(=O)C(=CO5)OC6=CC=CC=C6Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OC4=CC5=C(C=C4)C(=O)C(=CO5)OC6=CC=CC=C6Br

InChI

InChI=1S/C31H18BrNO7/c32-24-8-4-5-9-25(24)40-27-17-38-26-15-20(11-13-22(26)28(27)34)39-31(37)19-10-12-21-23(14-19)30(36)33(29(21)35)16-18-6-2-1-3-7-18/h1-15,17H,16H2