2-(2-methylbutyl)-3-[2-(2-piperidin-2-ylethoxy)phenoxy]-1-benzothiophen-6-ol

Systemtic Name: 2-(2-methylbutyl)-3-[2-(2-piperidin-2-ylethoxy)phenoxy]-1-benzothiophen-6-ol Openeye Name: 2-(2-methylbutyl)-3-[2-[2-(2-piperidyl)ethoxy]phenoxy]benzothiophen-6-ol CAS Name: 2-(2-methylbutyl)-3-[2-[2-(2-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-6-ol IUPAC Name: 2-(2-methylbutyl)-3-[2-(2-piperidin-2-ylethoxy)phenoxy]-1-benzothiophen-6-ol Traditional Name: 2-(2-methylbutyl)-3-[2-[2-(2-piperidyl)ethoxy]phenoxy]benzothiophen-6-ol Formula: C26H33NO3S MolecularWeight: 439.61012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(C2=C(S1)C=C(C=C2)O)OC3=CC=CC=C3OCCC4CCCCN4

Isomeric SMILES

CCC(C)CC1=C(C2=C(S1)C=C(C=C2)O)OC3=CC=CC=C3OCCC4CCCCN4

InChI

InChI=1S/C26H33NO3S/c1-3-18(2)16-25-26(21-12-11-20(28)17-24(21)31-25)30-23-10-5-4-9-22(23)29-15-13-19-8-6-7-14-27-19/h4-5,9-12,17-19,27-28H,3,6-8,13-16H2,1-2H3