3-(4-hydroxyphenyl)-3-methyl-4-[9-(2-piperidin-1-ylethylsulfinyl)nonyl]-2,4-dihydrochromen-7-ol

Systemtic Name: 3-(4-hydroxyphenyl)-3-methyl-4-[9-(2-piperidin-1-ylethylsulfinyl)nonyl]-2,4-dihydrochromen-7-ol Openeye Name: 3-(4-hydroxyphenyl)-3-methyl-4-[9-[2-(1-piperidyl)ethylsulfinyl]nonyl]chroman-7-ol CAS Name: 3-(4-hydroxyphenyl)-3-methyl-4-[9-[2-(1-piperidinyl)ethylsulfinyl]nonyl]-3,4-dihydro-2H-1-benzopyran-7-ol IUPAC Name: 3-(4-hydroxyphenyl)-3-methyl-4-[9-(2-piperidin-1-ylethylsulfinyl)nonyl]-2,4-dihydrochromen-7-ol Traditional Name: 3-(4-hydroxyphenyl)-3-methyl-4-[9-(2-piperidinoethylsulfinyl)nonyl]chroman-7-ol Formula: C32H47NO4S MolecularWeight: 541.78488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1CCCCCCCCCS(=O)CCN3CCCCC3)C=CC(=C2)O)C4=CC=C(C=C4)O

Isomeric SMILES

CC1(COC2=C(C1CCCCCCCCCS(=O)CCN3CCCCC3)C=CC(=C2)O)C4=CC=C(C=C4)O

InChI

InChI=1S/C32H47NO4S/c1-32(26-13-15-27(34)16-14-26)25-37-31-24-28(35)17-18-29(31)30(32)12-8-5-3-2-4-6-11-22-38(36)23-21-33-19-9-7-10-20-33/h13-18,24,30,34-35H,2-12,19-23,25H2,1H3