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

Systemtic Name: [4-[6-acetyloxy-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] undecanoate Openeye Name: [4-[6-acetoxy-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-2-yl]phenyl] undecanoate CAS Name: undecanoic acid [4-[6-acetyloxy-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[6-acetyloxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] undecanoate Traditional Name: undecanoic acid [4-[6-acetoxy-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl] ester Formula: C41H49NO6S MolecularWeight: 683.89586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OC(=O)C)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OC(=O)C)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C41H49NO6S/c1-3-4-5-6-7-8-9-11-14-38(44)48-34-21-17-32(18-22-34)41-39(36-24-23-35(47-30(2)43)29-37(36)49-41)40(45)31-15-19-33(20-16-31)46-28-27-42-25-12-10-13-26-42/h15-24,29H,3-14,25-28H2,1-2H3