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

Systemtic Name: [4-[6-acetyloxy-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] ethanoate Openeye Name: [4-[6-acetoxy-3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]benzothiophen-2-yl]phenyl] acetate CAS Name: acetic acid [4-[6-acetyloxy-3-[oxo-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[6-acetyloxy-3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] acetate Traditional Name: acetic acid [4-[6-acetoxy-3-[4-(2-pyrrolidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl] ester Formula: C31H29NO6S MolecularWeight: 543.63006

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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)OC(=O)C)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OC(=O)C)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C31H29NO6S/c1-20(33)37-25-11-7-23(8-12-25)31-29(27-14-13-26(38-21(2)34)19-28(27)39-31)30(35)22-5-9-24(10-6-22)36-18-17-32-15-3-4-16-32/h5-14,19H,3-4,15-18H2,1-2H3