4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione

Systemtic Name: 4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Openeye Name: 4-(2,5-dimethyl-3-thienyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1-benzopyran-2,5-dione IUPAC Name: 4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Traditional Name: 4-(2,5-dimethyl-3-thienyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-quinone Formula: C17H20O3S MolecularWeight: 304.4039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2CC(=O)OC3=C2C(=O)CC(C3)(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2CC(=O)OC3=C2C(=O)CC(C3)(C)C

InChI

InChI=1S/C17H20O3S/c1-9-5-11(10(2)21-9)12-6-15(19)20-14-8-17(3,4)7-13(18)16(12)14/h5,12H,6-8H2,1-4H3