2-(4-hydroxyphenyl)-3-[[4-[2-(3-methylpyrrolidin-1-yl)ethoxy]phenyl]methyl]-1-benzothiophen-6-ol

Systemtic Name: 2-(4-hydroxyphenyl)-3-[[4-[2-(3-methylpyrrolidin-1-yl)ethoxy]phenyl]methyl]-1-benzothiophen-6-ol Openeye Name: 2-(4-hydroxyphenyl)-3-[[4-[2-(3-methylpyrrolidin-1-yl)ethoxy]phenyl]methyl]benzothiophen-6-ol CAS Name: 2-(4-hydroxyphenyl)-3-[[4-[2-(3-methyl-1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-6-ol IUPAC Name: 2-(4-hydroxyphenyl)-3-[[4-[2-(3-methylpyrrolidin-1-yl)ethoxy]phenyl]methyl]-1-benzothiophen-6-ol Traditional Name: 2-(4-hydroxyphenyl)-3-[4-[2-(3-methylpyrrolidino)ethoxy]benzyl]benzothiophen-6-ol Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CC1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H29NO3S/c1-19-12-13-29(18-19)14-15-32-24-9-2-20(3-10-24)16-26-25-11-8-23(31)17-27(25)33-28(26)21-4-6-22(30)7-5-21/h2-11,17,19,30-31H,12-16,18H2,1H3