[4-[4,6-di(pentanoyloxy)-1-benzothiophen-2-yl]phenyl] pentanoate

Systemtic Name: [4-[4,6-di(pentanoyloxy)-1-benzothiophen-2-yl]phenyl] pentanoate Openeye Name: [4-[4,6-di(pentanoyloxy)benzothiophen-2-yl]phenyl] pentanoate CAS Name: pentanoic acid [4-[4,6-bis(1-oxopentoxy)-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[4,6-di(pentanoyloxy)-1-benzothiophen-2-yl]phenyl] pentanoate Traditional Name: valeric acid [4-(4,6-divaleryloxybenzothiophen-2-yl)phenyl] ester Formula: C29H34O6S MolecularWeight: 510.64166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3S2)OC(=O)CCCC)OC(=O)CCCC

Isomeric SMILES

CCCCC(=O)OC1=CC=C(C=C1)C2=CC3=C(C=C(C=C3S2)OC(=O)CCCC)OC(=O)CCCC

InChI

InChI=1S/C29H34O6S/c1-4-7-10-27(30)33-21-15-13-20(14-16-21)25-19-23-24(35-29(32)12-9-6-3)17-22(18-26(23)36-25)34-28(31)11-8-5-2/h13-19H,4-12H2,1-3H3