[5-(4-bromophenyl)carbonyloxy-6-(2-methylbutanoyl)-8-(3-methylbut-2-enyl)-2-oxidanylidene-4-phenyl-chromen-7-yl] 4-bromanylbenzoate

Systemtic Name: [5-(4-bromophenyl)carbonyloxy-6-(2-methylbutanoyl)-8-(3-methylbut-2-enyl)-2-oxidanylidene-4-phenyl-chromen-7-yl] 4-bromanylbenzoate Openeye Name: [5-(4-bromobenzoyl)oxy-6-(2-methylbutanoyl)-8-(3-methylbut-2-enyl)-2-oxo-4-phenyl-chromen-7-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [5-[(4-bromophenyl)-oxomethoxy]-8-(3-methylbut-2-enyl)-6-(2-methyl-1-oxobutyl)-2-oxo-4-phenyl-1-benzopyran-7-yl] ester IUPAC Name: [5-(4-bromobenzoyl)oxy-6-(2-methylbutanoyl)-8-(3-methylbut-2-enyl)-2-oxo-4-phenylchromen-7-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [5-(4-bromobenzoyl)oxy-2-keto-6-(2-methylbutanoyl)-8-(3-methylbut-2-enyl)-4-phenyl-chromen-7-yl] ester Formula: C39H32Br2O7 MolecularWeight: 772.47518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C1=C(C2=C(C(=C1OC(=O)C3=CC=C(C=C3)Br)CC=C(C)C)OC(=O)C=C2C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCC(C)C(=O)C1=C(C2=C(C(=C1OC(=O)C3=CC=C(C=C3)Br)CC=C(C)C)OC(=O)C=C2C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C39H32Br2O7/c1-5-23(4)34(43)33-36(47-38(44)25-12-16-27(40)17-13-25)29(20-11-22(2)3)35-32(30(21-31(42)46-35)24-9-7-6-8-10-24)37(33)48-39(45)26-14-18-28(41)19-15-26/h6-19,21,23H,5,20H2,1-4H3