O4-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl) O1-(phenylmethyl) benzene-1,4-dicarboxylate

Systemtic Name: O4-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl) O1-(phenylmethyl) benzene-1,4-dicarboxylate Openeye Name: O1-benzyl O4-(4,4-dimethylthiochroman-6-yl) benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl) ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl) benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O1-benzyl ester O4-(4,4-dimethylthiochroman-6-yl) ester Formula: C26H24O4S MolecularWeight: 432.53136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CCSC2=C1C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C26H24O4S/c1-26(2)14-15-31-23-13-12-21(16-22(23)26)30-25(28)20-10-8-19(9-11-20)24(27)29-17-18-6-4-3-5-7-18/h3-13,16H,14-15,17H2,1-2H3