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

Systemtic Name: [4-[6-ethynyl-3-[[4-(2-piperidin-2-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ethanoate Openeye Name: [4-[6-ethynyl-3-[[4-[2-(2-piperidyl)ethoxy]phenyl]methyl]benzothiophen-2-yl]phenyl] acetate CAS Name: acetic acid [4-[6-ethynyl-3-[[4-[2-(2-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[6-ethynyl-3-[[4-(2-piperidin-2-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]phenyl] acetate Traditional Name: acetic acid [4-[6-ethynyl-3-[4-[2-(2-piperidyl)ethoxy]benzyl]benzothiophen-2-yl]phenyl] ester Formula: C32H31NO3S MolecularWeight: 509.65844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C#C)CC4=CC=C(C=C4)OCCC5CCCCN5

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)C#C)CC4=CC=C(C=C4)OCCC5CCCCN5

InChI

InChI=1S/C32H31NO3S/c1-3-23-9-16-29-30(32(37-31(29)21-23)25-10-14-28(15-11-25)36-22(2)34)20-24-7-12-27(13-8-24)35-19-17-26-6-4-5-18-33-26/h1,7-16,21,26,33H,4-6,17-20H2,2H3