[4-[6-ethanoyl-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-ethyl-phenyl] ethanoate

Systemtic Name: [4-[6-ethanoyl-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-ethyl-phenyl] ethanoate Openeye Name: [4-[6-acetyl-3-[[4-[3-(1-piperidyl)propoxy]phenyl]methyl]benzothiophen-2-yl]-2-ethyl-phenyl] acetate CAS Name: acetic acid [4-[6-acetyl-3-[[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1-benzothiophen-2-yl]-2-ethylphenyl] ester IUPAC Name: [4-[6-acetyl-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-2-yl]-2-ethylphenyl] acetate Traditional Name: acetic acid [4-[6-acetyl-3-[4-(3-piperidinopropoxy)benzyl]benzothiophen-2-yl]-2-ethyl-phenyl] ester Formula: C35H39NO4S MolecularWeight: 569.75346

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=C(C3=C(S2)C=C(C=C3)C(=O)C)CC4=CC=C(C=C4)OCCCN5CCCCC5)OC(=O)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=C(C3=C(S2)C=C(C=C3)C(=O)C)CC4=CC=C(C=C4)OCCCN5CCCCC5)OC(=O)C

InChI

InChI=1S/C35H39NO4S/c1-4-27-22-29(12-16-33(27)40-25(3)38)35-32(31-15-11-28(24(2)37)23-34(31)41-35)21-26-9-13-30(14-10-26)39-20-8-19-36-17-6-5-7-18-36/h9-16,22-23H,4-8,17-21H2,1-3H3