1-[3-(2-hydroxyethylsulfonyl)-4-oxidanyl-5-phenylmethoxy-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-[3-(2-hydroxyethylsulfonyl)-4-oxidanyl-5-phenylmethoxy-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Openeye Name: 1-[3-benzyloxy-4-hydroxy-5-(2-hydroxyethylsulfonyl)phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione CAS Name: 1-[4-hydroxy-3-(2-hydroxyethylsulfonyl)-5-phenylmethoxyphenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione IUPAC Name: 1-[4-hydroxy-3-(2-hydroxyethylsulfonyl)-5-phenylmethoxyphenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Traditional Name: 1-[3-benzoxy-4-hydroxy-5-(2-hydroxyethylsulfonyl)phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Formula: C28H30O10S MolecularWeight: 558.5968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CCC(=O)C2=CC(=C(C(=C2)S(=O)(=O)CCO)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CCC(=O)C2=CC(=C(C(=C2)S(=O)(=O)CCO)O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H30O10S/c1-35-24-14-19(15-25(36-2)28(24)37-3)21(30)9-10-22(31)20-13-23(38-17-18-7-5-4-6-8-18)27(32)26(16-20)39(33,34)12-11-29/h4-8,13-16,29,32H,9-12,17H2,1-3H3