4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-7-ol

Systemtic Name: 4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-7-ol Openeye Name: 4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-chroman-7-ol CAS Name: 4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-7-ol IUPAC Name: 4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-7-ol Traditional Name: 4-(7-butylsulfinylheptoxymethyl)-3-(4-hydroxyphenyl)-3-methyl-chroman-7-ol Formula: C28H40O5S MolecularWeight: 488.6792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)CCCCCCCOCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCS(=O)CCCCCCCOCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O

InChI

InChI=1S/C28H40O5S/c1-3-4-17-34(31)18-9-7-5-6-8-16-32-20-26-25-15-14-24(30)19-27(25)33-21-28(26,2)22-10-12-23(29)13-11-22/h10-15,19,26,29-30H,3-9,16-18,20-21H2,1-2H3