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

Systemtic Name: [4-[6-ethenyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]-2-(phenylcarbonyloxy)phenyl] benzoate Openeye Name: [2-benzoyloxy-4-[3-[4-[2-(1-piperidyl)ethoxy]benzoyl]-6-vinyl-benzothiophen-2-yl]phenyl] benzoate CAS Name: benzoic acid [2-benzoyloxy-4-[6-ethenyl-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [2-benzoyloxy-4-[6-ethenyl-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] benzoate Traditional Name: benzoic acid [2-benzoyloxy-4-[3-[4-(2-piperidinoethoxy)benzoyl]-6-vinyl-benzothiophen-2-yl]phenyl] ester Formula: C44H37NO6S MolecularWeight: 707.83268

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)C(=O)C6=CC=C(C=C6)OCCN7CCCCC7

Isomeric SMILES

C=CC1=CC2=C(C=C1)C(=C(S2)C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)C(=O)C6=CC=C(C=C6)OCCN7CCCCC7

InChI

InChI=1S/C44H37NO6S/c1-2-30-16-22-36-39(28-30)52-42(40(36)41(46)31-17-20-35(21-18-31)49-27-26-45-24-10-5-11-25-45)34-19-23-37(50-43(47)32-12-6-3-7-13-32)38(29-34)51-44(48)33-14-8-4-9-15-33/h2-4,6-9,12-23,28-29H,1,5,10-11,24-27H2