2-(4-methoxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophene 1-oxide

Systemtic Name: 2-(4-methoxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophene 1-oxide Openeye Name: 2-(4-methoxyphenyl)-3-[4-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophene 1-oxide CAS Name: 2-(4-methoxyphenyl)-3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophene 1-oxide IUPAC Name: 2-(4-methoxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophene 1-oxide Traditional Name: 2-(4-methoxyphenyl)-3-[4-(2-piperidinoethoxy)phenoxy]benzothiophene 1-oxide Formula: C28H29NO4S MolecularWeight: 475.59916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2=O)OC4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2=O)OC4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C28H29NO4S/c1-31-22-11-9-21(10-12-22)28-27(25-7-3-4-8-26(25)34(28)30)33-24-15-13-23(14-16-24)32-20-19-29-17-5-2-6-18-29/h3-4,7-16H,2,5-6,17-20H2,1H3