[4-[6-ethanoyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-(phenylcarbonyloxy)phenyl] benzoate

Systemtic Name: [4-[6-ethanoyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-(phenylcarbonyloxy)phenyl] benzoate Openeye Name: [4-[6-acetyl-3-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]benzothiophen-2-yl]-2-benzoyloxy-phenyl] benzoate CAS Name: benzoic acid [4-[6-acetyl-3-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]-2-benzoyloxyphenyl] ester IUPAC Name: [4-[6-acetyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-benzoyloxyphenyl] benzoate Traditional Name: benzoic acid [4-[6-acetyl-3-[4-(2-piperidinoethoxy)benzyl]benzothiophen-2-yl]-2-benzoyloxy-phenyl] ester Formula: C44H39NO6S MolecularWeight: 709.84856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)CC6=CC=C(C=C6)OCCN7CCCCC7

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)CC6=CC=C(C=C6)OCCN7CCCCC7

InChI

InChI=1S/C44H39NO6S/c1-30(46)34-17-21-37-38(27-31-15-19-36(20-16-31)49-26-25-45-23-9-4-10-24-45)42(52-41(37)29-34)35-18-22-39(50-43(47)32-11-5-2-6-12-32)40(28-35)51-44(48)33-13-7-3-8-14-33/h2-3,5-8,11-22,28-29H,4,9-10,23-27H2,1H3