1-(8-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-2-ol; octan-1-amine

Systemtic Name: 1-(8-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-2-ol; octan-1-amine Openeye Name: 1-(8-methylthiochroman-6-yl)propan-2-ol; octan-1-amine CAS Name: 1-(8-methyl-3,4-dihydro-2H-1-benzothiopyran-6-yl)-2-propanol; 1-octanamine IUPAC Name: 1-(8-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-2-ol; octan-1-amine Traditional Name: 1-(8-methylthiochroman-6-yl)propan-2-ol; octylamine Formula: C21H37NOS MolecularWeight: 351.58958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN.CC1=C2C(=CC(=C1)CC(C)O)CCCS2

Isomeric SMILES

CCCCCCCCN.CC1=C2C(=CC(=C1)CC(C)O)CCCS2

InChI

InChI=1S/C13H18OS.C8H19N/c1-9-6-11(7-10(2)14)8-12-4-3-5-15-13(9)12;1-2-3-4-5-6-7-8-9/h6,8,10,14H,3-5,7H2,1-2H3;2-9H2,1H3