1-[2-[4-[[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenoxy]ethyl]piperidin-4-one

Systemtic Name: 1-[2-[4-[[2-(4-hydroxyphenyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenoxy]ethyl]piperidin-4-one Openeye Name: 1-[2-[4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]ethyl]piperidin-4-one CAS Name: 1-[2-[4-[[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-oxomethyl]phenoxy]ethyl]-4-piperidinone IUPAC Name: 1-[2-[4-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophene-3-carbonyl]phenoxy]ethyl]piperidin-4-one Traditional Name: 1-[2-[4-[6-hydroxy-2-(4-hydroxyphenyl)benzothiophene-3-carbonyl]phenoxy]ethyl]-4-piperidone Formula: C28H25NO5S MolecularWeight: 487.5668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CN(CCC1=O)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H25NO5S/c30-20-5-1-19(2-6-20)28-26(24-10-7-22(32)17-25(24)35-28)27(33)18-3-8-23(9-4-18)34-16-15-29-13-11-21(31)12-14-29/h1-10,17,30,32H,11-16H2