[2-(4-hydroxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] 3-chloranylbenzoate

Systemtic Name: [2-(4-hydroxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] 3-chloranylbenzoate Openeye Name: [2-(4-hydroxyphenyl)-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-6-yl] 3-chlorobenzoate CAS Name: 3-chlorobenzoic acid [2-(4-hydroxyphenyl)-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-6-yl] ester IUPAC Name: [2-(4-hydroxyphenyl)-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-6-yl] 3-chlorobenzoate Traditional Name: 3-chlorobenzoic acid [2-(4-hydroxyphenyl)-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-6-yl] ester Formula: C35H30ClNO5S MolecularWeight: 612.1344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)OC(=O)C5=CC(=CC=C5)Cl)C6=CC=C(C=C6)O

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)OC(=O)C5=CC(=CC=C5)Cl)C6=CC=C(C=C6)O

InChI

InChI=1S/C35H30ClNO5S/c36-26-6-4-5-25(21-26)35(40)42-29-15-16-30-31(22-29)43-34(24-7-11-27(38)12-8-24)32(30)33(39)23-9-13-28(14-10-23)41-20-19-37-17-2-1-3-18-37/h4-16,21-22,38H,1-3,17-20H2