2-(4-hydroxyphenyl)-3-[2-(3-piperidin-1-ylbutoxy)phenyl]-1-benzothiophen-6-ol

Systemtic Name: 2-(4-hydroxyphenyl)-3-[2-(3-piperidin-1-ylbutoxy)phenyl]-1-benzothiophen-6-ol Openeye Name: 2-(4-hydroxyphenyl)-3-[2-[3-(1-piperidyl)butoxy]phenyl]benzothiophen-6-ol CAS Name: 2-(4-hydroxyphenyl)-3-[2-[3-(1-piperidinyl)butoxy]phenyl]-1-benzothiophen-6-ol IUPAC Name: 2-(4-hydroxyphenyl)-3-[2-(3-piperidin-1-ylbutoxy)phenyl]-1-benzothiophen-6-ol Traditional Name: 2-(4-hydroxyphenyl)-3-[2-(3-piperidinobutoxy)phenyl]benzothiophen-6-ol Formula: C29H31NO3S MolecularWeight: 473.62634

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=CC=CC=C1C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)N5CCCCC5

Isomeric SMILES

CC(CCOC1=CC=CC=C1C2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O)N5CCCCC5

InChI

InChI=1S/C29H31NO3S/c1-20(30-16-5-2-6-17-30)15-18-33-26-8-4-3-7-24(26)28-25-14-13-23(32)19-27(25)34-29(28)21-9-11-22(31)12-10-21/h3-4,7-14,19-20,31-32H,2,5-6,15-18H2,1H3