N-(1,3-benzodioxol-4-ylmethyl)-6-methyl-heptan-2-amine

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-6-methyl-heptan-2-amine Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-6-methyl-heptan-2-amine CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-6-methyl-2-heptanamine IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-6-methylheptan-2-amine Traditional Name: 1,3-benzodioxol-4-ylmethyl(1,5-dimethylhexyl)amine Formula: C16H25NO2 MolecularWeight: 263.3752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NCC1=C2C(=CC=C1)OCO2

Isomeric SMILES

CC(C)CCCC(C)NCC1=C2C(=CC=C1)OCO2

InChI

InChI=1S/C16H25NO2/c1-12(2)6-4-7-13(3)17-10-14-8-5-9-15-16(14)19-11-18-15/h5,8-9,12-13,17H,4,6-7,10-11H2,1-3H3