3-[[4-(1-butoxyethoxy)phenyl]-oxidanyl-methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol

Systemtic Name: 3-[[4-(1-butoxyethoxy)phenyl]-oxidanyl-methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Openeye Name: 3-[[4-(1-butoxyethoxy)phenyl]-hydroxy-methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[[4-(1-butoxyethoxy)phenyl]-hydroxymethyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[[4-(1-butoxyethoxy)phenyl]-hydroxymethyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[[4-(1-butoxyethoxy)phenyl]-hydroxy-methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C27H28O5S MolecularWeight: 464.57322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OC1=CC=C(C=C1)C(C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)O

Isomeric SMILES

CCCCOC(C)OC1=CC=C(C=C1)C(C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)O

InChI

InChI=1S/C27H28O5S/c1-3-4-15-31-17(2)32-22-12-7-18(8-13-22)26(30)25-23-14-11-21(29)16-24(23)33-27(25)19-5-9-20(28)10-6-19/h5-14,16-17,26,28-30H,3-4,15H2,1-2H3