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

Systemtic Name: 1-[3-(2-hydroxyethylsulfonyl)-5-phenylmethoxy-4-propoxy-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Openeye Name: 1-[3-benzyloxy-5-(2-hydroxyethylsulfonyl)-4-propoxy-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol CAS Name: 1-[3-(2-hydroxyethylsulfonyl)-5-phenylmethoxy-4-propoxyphenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol IUPAC Name: 1-[3-(2-hydroxyethylsulfonyl)-5-phenylmethoxy-4-propoxyphenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Traditional Name: 1-[3-benzoxy-5-(2-hydroxyethylsulfonyl)-4-propoxy-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Formula: C31H40O10S MolecularWeight: 604.7083

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1S(=O)(=O)CCO)C(CCC(C2=CC(=C(C(=C2)OC)OC)OC)O)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=C(C=C(C=C1S(=O)(=O)CCO)C(CCC(C2=CC(=C(C(=C2)OC)OC)OC)O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H40O10S/c1-5-14-40-31-28(41-20-21-9-7-6-8-10-21)18-23(19-29(31)42(35,36)15-13-32)25(34)12-11-24(33)22-16-26(37-2)30(39-4)27(17-22)38-3/h6-10,16-19,24-25,32-34H,5,11-15,20H2,1-4H3