(E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propyl-hex-2-en-1-amine

Systemtic Name: (E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propyl-hex-2-en-1-amine Openeye Name: (E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propyl-hex-2-en-1-amine CAS Name: (E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propyl-2-hexen-1-amine IUPAC Name: (E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propylhex-2-en-1-amine Traditional Name: [(E,1S)-1-(1,3-benzodioxol-5-yl)-3-ethyl-2-propyl-hex-2-enyl]amine Formula: C18H27NO2 MolecularWeight: 289.41248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(CCC)C(C1=CC2=C(C=C1)OCO2)N)CC

Isomeric SMILES

CCC/C(=C(\CCC)/[C@H](C1=CC2=C(C=C1)OCO2)N)/CC

InChI

InChI=1S/C18H27NO2/c1-4-7-13(6-3)15(8-5-2)18(19)14-9-10-16-17(11-14)21-12-20-16/h9-11,18H,4-8,12,19H2,1-3H3/b15-13+/t18-/m0/s1