[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(2-oxidanyl-3-piperidin-1-yl-propoxy)phenyl]methanone

Systemtic Name: [2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(2-oxidanyl-3-piperidin-1-yl-propoxy)phenyl]methanone Openeye Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[4-[2-hydroxy-3-(1-piperidyl)propoxy]phenyl]methanone CAS Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-[2-hydroxy-3-(1-piperidinyl)propoxy]phenyl]methanone IUPAC Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-hydroxy-3-piperidin-1-ylpropoxy)phenyl]methanone Traditional Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[4-(2-hydroxy-3-piperidino-propoxy)phenyl]methanone Formula: C29H29NO5S MolecularWeight: 503.60926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(COC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O

Isomeric SMILES

C1CCN(CC1)CC(COC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O

InChI

InChI=1S/C29H29NO5S/c31-21-8-4-20(5-9-21)29-27(25-13-10-22(32)16-26(25)36-29)28(34)19-6-11-24(12-7-19)35-18-23(33)17-30-14-2-1-3-15-30/h4-13,16,23,31-33H,1-3,14-15,17-18H2