(3,5-dimethylphenyl)methyl 5-(phenylsulfonylmethyl)furan-2-carboxylate

Systemtic Name: (3,5-dimethylphenyl)methyl 5-(phenylsulfonylmethyl)furan-2-carboxylate Openeye Name: (3,5-dimethylphenyl)methyl 5-(benzenesulfonylmethyl)furan-2-carboxylate CAS Name: 5-(benzenesulfonylmethyl)-2-furancarboxylic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 5-(benzenesulfonylmethyl)furan-2-carboxylate Traditional Name: 5-(besylmethyl)furan-2-carboxylic acid (3,5-dimethylbenzyl) ester Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H20O5S/c1-15-10-16(2)12-17(11-15)13-25-21(22)20-9-8-18(26-20)14-27(23,24)19-6-4-3-5-7-19/h3-12H,13-14H2,1-2H3