2-[1-[4-[7-(4-acetyloxyphenyl)-5-(4-hydroxyphenyl)octan-3-yl]phenoxy]ethoxy]ethyl 2-thiophen-3-ylethanoate

Systemtic Name: 2-[1-[4-[7-(4-acetyloxyphenyl)-5-(4-hydroxyphenyl)octan-3-yl]phenoxy]ethoxy]ethyl 2-thiophen-3-ylethanoate Openeye Name: 2-[1-[4-[5-(4-acetoxyphenyl)-1-ethyl-3-(4-hydroxyphenyl)hexyl]phenoxy]ethoxy]ethyl 2-(3-thienyl)acetate CAS Name: 2-(3-thiophenyl)acetic acid 2-[1-[4-[7-(4-acetyloxyphenyl)-5-(4-hydroxyphenyl)octan-3-yl]phenoxy]ethoxy]ethyl ester IUPAC Name: 2-[1-[4-[7-(4-acetyloxyphenyl)-5-(4-hydroxyphenyl)octan-3-yl]phenoxy]ethoxy]ethyl 2-thiophen-3-ylacetate Traditional Name: 2-(3-thienyl)acetic acid 2-[1-[4-[5-(4-acetoxyphenyl)-1-ethyl-3-(4-hydroxyphenyl)hexyl]phenoxy]ethoxy]ethyl ester Formula: C38H44O7S MolecularWeight: 644.81676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(C)C1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)O)C3=CC=C(C=C3)OC(C)OCCOC(=O)CC4=CSC=C4

Isomeric SMILES

CCC(CC(CC(C)C1=CC=C(C=C1)OC(=O)C)C2=CC=C(C=C2)O)C3=CC=C(C=C3)OC(C)OCCOC(=O)CC4=CSC=C4

InChI

InChI=1S/C38H44O7S/c1-5-30(32-10-16-37(17-11-32)45-28(4)42-19-20-43-38(41)23-29-18-21-46-25-29)24-34(33-6-12-35(40)13-7-33)22-26(2)31-8-14-36(15-9-31)44-27(3)39/h6-18,21,25-26,28,30,34,40H,5,19-20,22-24H2,1-4H3