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

Systemtic Name: [2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]-[2-(1-pyrrolidin-1-ylethoxy)phenyl]methanone Openeye Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[2-(1-pyrrolidin-1-ylethoxy)phenyl]methanone CAS Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[2-[1-(1-pyrrolidinyl)ethoxy]phenyl]methanone IUPAC Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[2-(1-pyrrolidin-1-ylethoxy)phenyl]methanone Traditional Name: [6-hydroxy-2-(4-hydroxyphenyl)benzothiophen-3-yl]-[2-(1-pyrrolidinoethoxy)phenyl]methanone Formula: C27H25NO4S MolecularWeight: 459.5567

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCC1)OC2=CC=CC=C2C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CC(N1CCCC1)OC2=CC=CC=C2C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C27H25NO4S/c1-17(28-14-4-5-15-28)32-23-7-3-2-6-21(23)26(31)25-22-13-12-20(30)16-24(22)33-27(25)18-8-10-19(29)11-9-18/h2-3,6-13,16-17,29-30H,4-5,14-15H2,1H3