[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(8-pyrrolidin-1-yloctoxy)phenyl]methanone

Systemtic Name: [2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(8-pyrrolidin-1-yloctoxy)phenyl]methanone Openeye Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[4-(8-pyrrolidin-1-yloctoxy)phenyl]methanone CAS Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-[8-(1-pyrrolidinyl)octoxy]phenyl]methanone IUPAC Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(8-pyrrolidin-1-yloctoxy)phenyl]methanone Traditional Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[4-(8-pyrrolidinooctoxy)phenyl]methanone Formula: C33H37NO4S MolecularWeight: 543.71618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCCCCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CCN(C1)CCCCCCCCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C33H37NO4S/c35-26-13-9-25(10-14-26)33-31(29-18-15-27(36)23-30(29)39-33)32(37)24-11-16-28(17-12-24)38-22-8-4-2-1-3-5-19-34-20-6-7-21-34/h9-18,23,35-36H,1-8,19-22H2