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

Systemtic Name: 2-(4-hydroxyphenyl)-3-[oxidanyl-[4-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]methyl]-1-benzothiophen-6-ol Openeye Name: 3-[hydroxy-[4-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)phenyl]methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol CAS Name: 3-[hydroxy-[4-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol IUPAC Name: 3-[hydroxy-[4-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)phenyl]methyl]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol Traditional Name: 3-[hydroxy-[4-(2-hydroxy-3-pyrrolidino-propoxy)phenyl]methyl]-2-(4-hydroxyphenyl)benzothiophen-6-ol Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(COC2=CC=C(C=C2)C(C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O)O

Isomeric SMILES

C1CCN(C1)CC(COC2=CC=C(C=C2)C(C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O)O

InChI

InChI=1S/C28H29NO5S/c30-20-7-3-19(4-8-20)28-26(24-12-9-21(31)15-25(24)35-28)27(33)18-5-10-23(11-6-18)34-17-22(32)16-29-13-1-2-14-29/h3-12,15,22,27,30-33H,1-2,13-14,16-17H2