[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-pentyl-azanium

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-pentyl-azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-pentyl-ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-pentylammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-pentylazanium Traditional Name: amyl-[(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]C(C)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCC[NH2+][C@H](C)CCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H25NO2/c1-3-4-5-10-17-13(2)6-7-14-8-9-15-16(11-14)19-12-18-15/h8-9,11,13,17H,3-7,10,12H2,1-2H3/p+1/t13-/m1/s1