(4-cyclohexyloxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate

Systemtic Name: (4-cyclohexyloxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate Openeye Name: [4-(cyclohexoxycarbonyl)phenyl] 4,4-dimethylthiochromane-6-carboxylate CAS Name: 4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-carboxylic acid [4-[cyclohexyloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-cyclohexyloxycarbonylphenyl) 4,4-dimethyl-2,3-dihydrothiochromene-6-carboxylate Traditional Name: 4,4-dimethylthiochroman-6-carboxylic acid [4-(cyclohexoxycarbonyl)phenyl] ester Formula: C25H28O4S MolecularWeight: 424.55242

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=C1C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC4CCCCC4)C

Isomeric SMILES

CC1(CCSC2=C1C=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC4CCCCC4)C

InChI

InChI=1S/C25H28O4S/c1-25(2)14-15-30-22-13-10-18(16-21(22)25)24(27)29-20-11-8-17(9-12-20)23(26)28-19-6-4-3-5-7-19/h8-13,16,19H,3-7,14-15H2,1-2H3