3-[1-(2,5-dimethylthiophen-3-yl)octadecyl]-4-propan-2-ylidene-oxolane-2,5-dione

Systemtic Name: 3-[1-(2,5-dimethylthiophen-3-yl)octadecyl]-4-propan-2-ylidene-oxolane-2,5-dione Openeye Name: 3-[1-(2,5-dimethyl-3-thienyl)octadecyl]-4-isopropylidene-tetrahydrofuran-2,5-dione CAS Name: 3-[1-(2,5-dimethyl-3-thiophenyl)octadecyl]-4-propan-2-ylideneoxolane-2,5-dione IUPAC Name: 3-[1-(2,5-dimethylthiophen-3-yl)octadecyl]-4-propan-2-ylideneoxolane-2,5-dione Traditional Name: 3-[1-(2,5-dimethyl-3-thienyl)octadecyl]-4-isopropylidene-tetrahydrofuran-2,5-quinone Formula: C31H50O3S MolecularWeight: 502.7919

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C1C(=C(C)C)C(=O)OC1=O)C2=C(SC(=C2)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C1C(=C(C)C)C(=O)OC1=O)C2=C(SC(=C2)C)C

InChI

InChI=1S/C31H50O3S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(27-22-24(4)35-25(27)5)29-28(23(2)3)30(32)34-31(29)33/h22,26,29H,6-21H2,1-5H3