[4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2,6-bis(bromanyl)-3,4,5-trimethoxy-benzoate

Systemtic Name: [4-oxidanylidene-3-(4-phenylphenoxy)chromen-7-yl] 2,6-bis(bromanyl)-3,4,5-trimethoxy-benzoate Openeye Name: [4-oxo-3-(4-phenylphenoxy)chromen-7-yl] 2,6-dibromo-3,4,5-trimethoxy-benzoate CAS Name: 2,6-dibromo-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] 2,6-dibromo-3,4,5-trimethoxybenzoate Traditional Name: 2,6-dibromo-3,4,5-trimethoxy-benzoic acid [4-keto-3-(4-phenylphenoxy)chromen-7-yl] ester Formula: C31H22Br2O8 MolecularWeight: 682.30958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1OC)Br)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Br)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1OC)Br)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=C(C=C4)C5=CC=CC=C5)Br)OC

InChI

InChI=1S/C31H22Br2O8/c1-36-28-25(32)24(26(33)29(37-2)30(28)38-3)31(35)41-20-13-14-21-22(15-20)39-16-23(27(21)34)40-19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,1-3H3