3-[3,5-bis(4-hexylphenyl)-1-phenyl-hexyl]-4-methyl-oxolane-2,5-dione

Systemtic Name: 3-[3,5-bis(4-hexylphenyl)-1-phenyl-hexyl]-4-methyl-oxolane-2,5-dione Openeye Name: 3-[3,5-bis(4-hexylphenyl)-1-phenyl-hexyl]-4-methyl-tetrahydrofuran-2,5-dione CAS Name: 3-[3,5-bis(4-hexylphenyl)-1-phenylhexyl]-4-methyloxolane-2,5-dione IUPAC Name: 3-[3,5-bis(4-hexylphenyl)-1-phenylhexyl]-4-methyloxolane-2,5-dione Traditional Name: 3-[3,5-bis(4-hexylphenyl)-1-phenyl-hexyl]-4-methyl-tetrahydrofuran-2,5-quinone Formula: C41H54O3 MolecularWeight: 594.86566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(C)CC(CC(C2C(C(=O)OC2=O)C)C3=CC=CC=C3)C4=CC=C(C=C4)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(C)CC(CC(C2C(C(=O)OC2=O)C)C3=CC=CC=C3)C4=CC=C(C=C4)CCCCCC

InChI

InChI=1S/C41H54O3/c1-5-7-9-12-16-32-20-24-34(25-21-32)30(3)28-37(35-26-22-33(23-27-35)17-13-10-8-6-2)29-38(36-18-14-11-15-19-36)39-31(4)40(42)44-41(39)43/h11,14-15,18-27,30-31,37-39H,5-10,12-13,16-17,28-29H2,1-4H3