[2-cyclohexyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-yl] benzoate hydrochloride

Systemtic Name: [2-cyclohexyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-yl] benzoate hydrochloride Openeye Name: [2-cyclohexyl-3-[4-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophen-6-yl] benzoate hydrochloride CAS Name: benzoic acid [2-cyclohexyl-3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-6-yl] ester hydrochloride IUPAC Name: [2-cyclohexyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-yl] benzoate hydrochloride Traditional Name: benzoic acid [2-cyclohexyl-3-[4-(2-piperidinoethoxy)phenoxy]benzothiophen-6-yl] ester hydrochloride Formula: C34H38ClNO4S MolecularWeight: 592.18782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)OC(=O)C4=CC=CC=C4)OC5=CC=C(C=C5)OCCN6CCCCC6.Cl

Isomeric SMILES

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)OC(=O)C4=CC=CC=C4)OC5=CC=C(C=C5)OCCN6CCCCC6.Cl

InChI

InChI=1S/C34H37NO4S.ClH/c36-34(26-12-6-2-7-13-26)39-29-18-19-30-31(24-29)40-33(25-10-4-1-5-11-25)32(30)38-28-16-14-27(15-17-28)37-23-22-35-20-8-3-9-21-35;/h2,6-7,12-19,24-25H,1,3-5,8-11,20-23H2;1H