[4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [4-oxo-3-(4-phenylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C31H23BrO8 MolecularWeight: 603.41352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Br)OC)OC

InChI

InChI=1S/C31H23BrO8/c1-35-25-16-23(27(32)30(37-3)29(25)36-2)31(34)40-21-13-14-22-24(15-21)38-17-26(28(22)33)39-20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-17H,1-3H3