ethyl 4-octyl-5-phenyl-2-propan-2-yl-2,5-dihydrothiophene-3-carboxylate

Systemtic Name: ethyl 4-octyl-5-phenyl-2-propan-2-yl-2,5-dihydrothiophene-3-carboxylate Openeye Name: ethyl 2-isopropyl-4-octyl-5-phenyl-2,5-dihydrothiophene-3-carboxylate CAS Name: 4-octyl-5-phenyl-2-propan-2-yl-2,5-dihydrothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-octyl-5-phenyl-2-propan-2-yl-2,5-dihydrothiophene-3-carboxylate Traditional Name: 2-isopropyl-4-octyl-5-phenyl-2,5-dihydrothiophene-3-carboxylic acid ethyl ester Formula: C24H36O2S MolecularWeight: 388.60644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(SC1C2=CC=CC=C2)C(C)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCC1=C(C(SC1C2=CC=CC=C2)C(C)C)C(=O)OCC

InChI

InChI=1S/C24H36O2S/c1-5-7-8-9-10-14-17-20-21(24(25)26-6-2)22(18(3)4)27-23(20)19-15-12-11-13-16-19/h11-13,15-16,18,22-23H,5-10,14,17H2,1-4H3