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

Systemtic Name: methyl 2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophene-6-carboxylate Openeye Name: methyl 2-(4-fluorophenyl)-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophene-6-carboxylate CAS Name: 2-(4-fluorophenyl)-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophene-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophene-6-carboxylate Traditional Name: 2-(4-fluorophenyl)-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophene-6-carboxylic acid methyl ester Formula: C30H28FNO4S MolecularWeight: 517.611023

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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)F)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C30H28FNO4S/c1-35-30(34)22-9-14-25-26(19-22)37-29(21-5-10-23(31)11-6-21)27(25)28(33)20-7-12-24(13-8-20)36-18-17-32-15-3-2-4-16-32/h5-14,19H,2-4,15-18H2,1H3