2,2,8-trimethyl-7-(3-methylbutyl)-5-(prop-2-enylsulfanylmethyl)-3,4-dihydrochromen-6-ol

Systemtic Name: 2,2,8-trimethyl-7-(3-methylbutyl)-5-(prop-2-enylsulfanylmethyl)-3,4-dihydrochromen-6-ol Openeye Name: 5-(allylsulfanylmethyl)-7-isopentyl-2,2,8-trimethyl-chroman-6-ol CAS Name: 2,2,8-trimethyl-7-(3-methylbutyl)-5-[(prop-2-enylthio)methyl]-3,4-dihydro-2H-1-benzopyran-6-ol IUPAC Name: 2,2,8-trimethyl-7-(3-methylbutyl)-5-(prop-2-enylsulfanylmethyl)-3,4-dihydrochromen-6-ol Traditional Name: 5-[(allylthio)methyl]-7-isoamyl-2,2,8-trimethyl-chroman-6-ol Formula: C21H32O2S MolecularWeight: 348.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1CCC(C)C)O)CSCC=C)CCC(O2)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1CCC(C)C)O)CSCC=C)CCC(O2)(C)C

InChI

InChI=1S/C21H32O2S/c1-7-12-24-13-18-17-10-11-21(5,6)23-20(17)15(4)16(19(18)22)9-8-14(2)3/h7,14,22H,1,8-13H2,2-6H3