4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol

Systemtic Name: 4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol Openeye Name: 4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)chroman-7-ol CAS Name: 4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-ol IUPAC Name: 4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-ol Traditional Name: 4-[2-(6-butylsulfinylhexoxy)ethyl]-3-(4-hydroxyphenyl)chroman-7-ol Formula: C27H38O5S MolecularWeight: 474.65262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)CCCCCCOCCC1C(COC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCCS(=O)CCCCCCOCCC1C(COC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C27H38O5S/c1-2-3-17-33(30)18-7-5-4-6-15-31-16-14-24-25-13-12-23(29)19-27(25)32-20-26(24)21-8-10-22(28)11-9-21/h8-13,19,24,26,28-29H,2-7,14-18,20H2,1H3