[4-[6-ethenyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl] butanoate

Systemtic Name: [4-[6-ethenyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl] butanoate Openeye Name: [4-[3-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]-6-vinyl-benzothiophen-2-yl]phenyl] butanoate CAS Name: butanoic acid [4-[6-ethenyl-3-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[6-ethenyl-3-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl] butanoate Traditional Name: butyric acid [4-[3-[4-(2-piperidinoethoxy)benzyl]-6-vinyl-benzothiophen-2-yl]phenyl] ester Formula: C34H37NO3S MolecularWeight: 539.72748

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C=C)CC4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C=C)CC4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C34H37NO3S/c1-3-8-33(36)38-29-16-12-27(13-17-29)34-31(30-18-11-25(4-2)24-32(30)39-34)23-26-9-14-28(15-10-26)37-22-21-35-19-6-5-7-20-35/h4,9-18,24H,2-3,5-8,19-23H2,1H3