(4-ethoxycarbonylphenyl) 4,4,7-trimethyl-2,3-dihydrothiochromene-6-carboxylate

Systemtic Name: (4-ethoxycarbonylphenyl) 4,4,7-trimethyl-2,3-dihydrothiochromene-6-carboxylate Openeye Name: (4-ethoxycarbonylphenyl) 4,4,7-trimethylthiochromane-6-carboxylate CAS Name: 4,4,7-trimethyl-2,3-dihydro-1-benzothiopyran-6-carboxylic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 4,4,7-trimethyl-2,3-dihydrothiochromene-6-carboxylate Traditional Name: 4,4,7-trimethylthiochroman-6-carboxylic acid (4-carbethoxyphenyl) ester Formula: C22H24O4S MolecularWeight: 384.48856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2C)SCCC3(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2C)SCCC3(C)C

InChI

InChI=1S/C22H24O4S/c1-5-25-20(23)15-6-8-16(9-7-15)26-21(24)17-13-18-19(12-14(17)2)27-11-10-22(18,3)4/h6-9,12-13H,5,10-11H2,1-4H3