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

Systemtic Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]cyclohexanamine Openeye Name: N-[[(1S)-isochroman-1-yl]methyl]cyclohexanamine CAS Name: N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]cyclohexanamine IUPAC Name: N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]cyclohexanamine Traditional Name: cyclohexyl-[[(1S)-isochroman-1-yl]methyl]amine Formula: C16H23NO MolecularWeight: 245.35992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2C3=CC=CC=C3CCO2

Isomeric SMILES

C1CCC(CC1)NC[C@@H]2C3=CC=CC=C3CCO2

InChI

InChI=1S/C16H23NO/c1-2-7-14(8-3-1)17-12-16-15-9-5-4-6-13(15)10-11-18-16/h4-6,9,14,16-17H,1-3,7-8,10-12H2/t16-/m1/s1