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

Systemtic Name: [4-[6-ethanoyl-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] benzoate Openeye Name: [4-[6-acetyl-3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]benzothiophen-2-yl]phenyl] benzoate CAS Name: benzoic acid [4-[6-acetyl-3-[oxo-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[6-acetyl-3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[6-acetyl-3-[4-(2-pyrrolidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl] ester Formula: C36H31NO5S MolecularWeight: 589.70004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OCCN6CCCC6

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OCCN6CCCC6

InChI

InChI=1S/C36H31NO5S/c1-24(38)28-13-18-31-32(23-28)43-35(26-11-16-30(17-12-26)42-36(40)27-7-3-2-4-8-27)33(31)34(39)25-9-14-29(15-10-25)41-22-21-37-19-5-6-20-37/h2-4,7-18,23H,5-6,19-22H2,1H3