methyl 7-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrothiochromen-4-yl]heptanoate

Systemtic Name: methyl 7-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrothiochromen-4-yl]heptanoate Openeye Name: methyl 7-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-thiochroman-4-yl]heptanoate CAS Name: 7-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydro-1-benzothiopyran-4-yl]heptanoic acid methyl ester IUPAC Name: methyl 7-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrothiochromen-4-yl]heptanoate Traditional Name: 7-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-thiochroman-4-yl]enanthic acid methyl ester Formula: C24H30O4S MolecularWeight: 414.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCC(=O)OC)C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CC1(CSC2=C(C1CCCCCCC(=O)OC)C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C24H30O4S/c1-24(17-9-11-18(25)12-10-17)16-29-22-15-19(26)13-14-20(22)21(24)7-5-3-4-6-8-23(27)28-2/h9-15,21,25-26H,3-8,16H2,1-2H3