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

Systemtic Name: [2-[6-methyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] benzoate Openeye Name: [2-[6-methyl-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-2-yl]phenyl] benzoate CAS Name: benzoic acid [2-[6-methyl-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [2-[6-methyl-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] benzoate Traditional Name: benzoic acid [2-[6-methyl-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl] ester Formula: C36H33NO4S MolecularWeight: 575.71652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=CC=C3OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OCCN6CCCCC6

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=CC=C3OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OCCN6CCCCC6

InChI

InChI=1S/C36H33NO4S/c1-25-14-19-30-32(24-25)42-35(29-12-6-7-13-31(29)41-36(39)27-10-4-2-5-11-27)33(30)34(38)26-15-17-28(18-16-26)40-23-22-37-20-8-3-9-21-37/h2,4-7,10-19,24H,3,8-9,20-23H2,1H3