N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]hexan-1-amine

Systemtic Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]hexan-1-amine Openeye Name: N-[[(1S)-isochroman-1-yl]methyl]hexan-1-amine CAS Name: N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-1-hexanamine IUPAC Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]hexan-1-amine Traditional Name: hexyl-[[(1S)-isochroman-1-yl]methyl]amine Formula: C16H25NO MolecularWeight: 247.3758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCC1C2=CC=CC=C2CCO1

Isomeric SMILES

CCCCCCNC[C@@H]1C2=CC=CC=C2CCO1

InChI

InChI=1S/C16H25NO/c1-2-3-4-7-11-17-13-16-15-9-6-5-8-14(15)10-12-18-16/h5-6,8-9,16-17H,2-4,7,10-13H2,1H3/t16-/m1/s1