4-(1-benzothiophen-3-yl)-5-[(2-hydroxyphenyl)methyl]-3-(2-piperidin-1-ylethoxy)cyclohexa-2,4-dien-1-ol

Systemtic Name: 4-(1-benzothiophen-3-yl)-5-[(2-hydroxyphenyl)methyl]-3-(2-piperidin-1-ylethoxy)cyclohexa-2,4-dien-1-ol Openeye Name: 4-(benzothiophen-3-yl)-5-[(2-hydroxyphenyl)methyl]-3-[2-(1-piperidyl)ethoxy]cyclohexa-2,4-dien-1-ol CAS Name: 4-(1-benzothiophen-3-yl)-5-[(2-hydroxyphenyl)methyl]-3-[2-(1-piperidinyl)ethoxy]-1-cyclohexa-2,4-dienol IUPAC Name: 4-(1-benzothiophen-3-yl)-5-[(2-hydroxyphenyl)methyl]-3-(2-piperidin-1-ylethoxy)cyclohexa-2,4-dien-1-ol Traditional Name: 4-(benzothiophen-3-yl)-3-(2-piperidinoethoxy)-5-salicyl-cyclohexa-2,4-dien-1-ol Formula: C28H31NO3S MolecularWeight: 461.61564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC(CC(=C2C3=CSC4=CC=CC=C43)CC5=CC=CC=C5O)O

Isomeric SMILES

C1CCN(CC1)CCOC2=CC(CC(=C2C3=CSC4=CC=CC=C43)CC5=CC=CC=C5O)O

InChI

InChI=1S/C28H31NO3S/c30-22-17-21(16-20-8-2-4-10-25(20)31)28(24-19-33-27-11-5-3-9-23(24)27)26(18-22)32-15-14-29-12-6-1-7-13-29/h2-5,8-11,18-19,22,30-31H,1,6-7,12-17H2