3-(4-hydroxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1,4-benzoxathiin-6-ol

Systemtic Name: 3-(4-hydroxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1,4-benzoxathiin-6-ol Openeye Name: 3-(4-hydroxyphenyl)-2-[4-[2-(1-piperidyl)ethoxy]phenyl]-1,4-benzoxathiin-6-ol CAS Name: 3-(4-hydroxyphenyl)-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-1,4-benzoxathiin-6-ol IUPAC Name: 3-(4-hydroxyphenyl)-2-[4-(2-piperidin-1-ylethoxy)phenyl]-1,4-benzoxathiin-6-ol Traditional Name: 3-(4-hydroxyphenyl)-2-[4-(2-piperidinoethoxy)phenyl]-1,4-benzoxathiin-6-ol Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(SC4=C(O3)C=CC(=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C3=C(SC4=C(O3)C=CC(=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C27H27NO4S/c29-21-8-4-20(5-9-21)27-26(32-24-13-10-22(30)18-25(24)33-27)19-6-11-23(12-7-19)31-17-16-28-14-2-1-3-15-28/h4-13,18,29-30H,1-3,14-17H2