[4-bromanyloxy-4-(2-methylphenyl)carbonyl-3-(2-methylphenyl)carbonyloxy-5-oxidanyl-oxolan-2-yl]methyl 2-methylbenzoate

Systemtic Name: [4-bromanyloxy-4-(2-methylphenyl)carbonyl-3-(2-methylphenyl)carbonyloxy-5-oxidanyl-oxolan-2-yl]methyl 2-methylbenzoate Openeye Name: [4-bromooxy-5-hydroxy-4-(2-methylbenzoyl)-3-(2-methylbenzoyl)oxy-tetrahydrofuran-2-yl]methyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-bromooxy-5-hydroxy-3-[(2-methylphenyl)-oxomethoxy]-4-[(2-methylphenyl)-oxomethyl]-2-oxolanyl]methyl ester IUPAC Name: [4-bromooxy-5-hydroxy-4-(2-methylbenzoyl)-3-(2-methylbenzoyl)oxyoxolan-2-yl]methyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid (4-bromooxy-5-hydroxy-4-o-toluoyl-3-o-toluoyloxy-tetrahydrofuran-2-yl)methyl ester Formula: C29H27BrO8 MolecularWeight: 583.42388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2(C(C(OC2O)COC(=O)C3=CC=CC=C3C)OC(=O)C4=CC=CC=C4C)OBr

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2(C(C(OC2O)COC(=O)C3=CC=CC=C3C)OC(=O)C4=CC=CC=C4C)OBr

InChI

InChI=1S/C29H27BrO8/c1-17-10-4-7-13-20(17)24(31)29(38-30)25(37-27(33)22-15-9-6-12-19(22)3)23(36-28(29)34)16-35-26(32)21-14-8-5-11-18(21)2/h4-15,23,25,28,34H,16H2,1-3H3