diethyl 3-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)benzene-1,2-dicarboxylate

Systemtic Name: diethyl 3-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)benzene-1,2-dicarboxylate Openeye Name: diethyl 3-(4,4-dimethylthiochroman-6-yl)benzene-1,2-dicarboxylate CAS Name: 3-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)benzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)benzene-1,2-dicarboxylate Traditional Name: 3-(4,4-dimethylthiochroman-6-yl)benzene-1,2-dicarboxylic acid diethyl ester Formula: C23H26O4S MolecularWeight: 398.51514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1C(=O)OCC)C2=CC3=C(C=C2)SCCC3(C)C

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1C(=O)OCC)C2=CC3=C(C=C2)SCCC3(C)C

InChI

InChI=1S/C23H26O4S/c1-5-26-21(24)17-9-7-8-16(20(17)22(25)27-6-2)15-10-11-19-18(14-15)23(3,4)12-13-28-19/h7-11,14H,5-6,12-13H2,1-4H3