2-(4-hydroxyphenyl)-3-[oxidanyl-[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol

Systemtic Name: 2-(4-hydroxyphenyl)-3-[oxidanyl-[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol Openeye Name: 2-(4-hydroxyphenyl)-3-[hydroxy-[4-[3-(1-piperidyl)propoxy]phenyl]methyl]benzothiophen-6-ol CAS Name: 2-(4-hydroxyphenyl)-3-[hydroxy-[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1-benzothiophen-6-ol IUPAC Name: 2-(4-hydroxyphenyl)-3-[hydroxy-[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol Traditional Name: 2-(4-hydroxyphenyl)-3-[hydroxy-[4-(3-piperidinopropoxy)phenyl]methyl]benzothiophen-6-ol Formula: C29H31NO4S MolecularWeight: 489.62574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O)O

InChI

InChI=1S/C29H31NO4S/c31-22-9-5-21(6-10-22)29-27(25-14-11-23(32)19-26(25)35-29)28(33)20-7-12-24(13-8-20)34-18-4-17-30-15-2-1-3-16-30/h5-14,19,28,31-33H,1-4,15-18H2