2-[3,4-bis(phenylmethoxy)phenyl]-3-(8-bromanyloctoxy)chromen-4-one

Systemtic Name: 2-[3,4-bis(phenylmethoxy)phenyl]-3-(8-bromanyloctoxy)chromen-4-one Openeye Name: 3-(8-bromooctoxy)-2-(3,4-dibenzyloxyphenyl)chromen-4-one CAS Name: 2-[3,4-bis(phenylmethoxy)phenyl]-3-(8-bromooctoxy)-1-benzopyran-4-one IUPAC Name: 2-[3,4-bis(phenylmethoxy)phenyl]-3-(8-bromooctoxy)chromen-4-one Traditional Name: 3-(8-bromooctoxy)-2-(3,4-dibenzoxyphenyl)chromone Formula: C37H37BrO5 MolecularWeight: 641.59068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)OCCCCCCCCBr)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=C(C(=O)C4=CC=CC=C4O3)OCCCCCCCCBr)OCC5=CC=CC=C5

InChI

InChI=1S/C37H37BrO5/c38-23-13-3-1-2-4-14-24-40-37-35(39)31-19-11-12-20-32(31)43-36(37)30-21-22-33(41-26-28-15-7-5-8-16-28)34(25-30)42-27-29-17-9-6-10-18-29/h5-12,15-22,25H,1-4,13-14,23-24,26-27H2