2-cyclohexa-2,4-dien-1-yl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol

Systemtic Name: 2-cyclohexa-2,4-dien-1-yl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol Openeye Name: 2-cyclohexa-2,4-dien-1-yl-3-[4-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophen-6-ol CAS Name: 2-(1-cyclohexa-2,4-dienyl)-3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-6-ol IUPAC Name: 2-cyclohexa-2,4-dien-1-yl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol Traditional Name: 2-cyclohexa-2,4-dien-1-yl-3-[4-(2-piperidinoethoxy)phenoxy]benzothiophen-6-ol Formula: C27H29NO3S MolecularWeight: 447.58906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5CC=CC=C5

InChI

InChI=1S/C27H29NO3S/c29-21-9-14-24-25(19-21)32-27(20-7-3-1-4-8-20)26(24)31-23-12-10-22(11-13-23)30-18-17-28-15-5-2-6-16-28/h1,3-4,7,9-14,19-20,29H,2,5-6,8,15-18H2