methyl 2-[4-(phenylcarbonyloxy)phenyl]-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophene-6-carboxylate

Systemtic Name: methyl 2-[4-(phenylcarbonyloxy)phenyl]-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophene-6-carboxylate Openeye Name: methyl 2-(4-benzoyloxyphenyl)-3-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]benzothiophene-6-carboxylate CAS Name: 2-(4-benzoyloxyphenyl)-3-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophene-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-benzoyloxyphenyl)-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophene-6-carboxylate Traditional Name: 2-(4-benzoyloxyphenyl)-3-[4-(2-piperidinoethoxy)benzyl]benzothiophene-6-carboxylic acid methyl ester Formula: C37H35NO5S MolecularWeight: 605.7425

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)CC5=CC=C(C=C5)OCCN6CCCCC6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)CC5=CC=C(C=C5)OCCN6CCCCC6

InChI

InChI=1S/C37H35NO5S/c1-41-36(39)29-14-19-32-33(24-26-10-15-30(16-11-26)42-23-22-38-20-6-3-7-21-38)35(44-34(32)25-29)27-12-17-31(18-13-27)43-37(40)28-8-4-2-5-9-28/h2,4-5,8-19,25H,3,6-7,20-24H2,1H3