(1S,3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-cyclohexan-1-amine

Systemtic Name: (1S,3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-cyclohexan-1-amine Openeye Name: (1S,3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-cyclohexanamine CAS Name: (1S,3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-1-cyclohexanamine IUPAC Name: (1S,3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-methylcyclohexan-1-amine Traditional Name: [(1S,3R)-3-methylcyclohexyl]-piperonyl-amine Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@H]1CCC[C@@H](C1)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H21NO2/c1-11-3-2-4-13(7-11)16-9-12-5-6-14-15(8-12)18-10-17-14/h5-6,8,11,13,16H,2-4,7,9-10H2,1H3/t11-,13+/m1/s1