[(2R)-butan-2-yl]-[(3-butoxy-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[(3-butoxy-4-methoxy-phenyl)methyl]azanium Openeye Name: (3-butoxy-4-methoxy-phenyl)methyl-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[(3-butoxy-4-methoxyphenyl)methyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[(3-butoxy-4-methoxyphenyl)methyl]azanium Traditional Name: (3-butoxy-4-methoxy-benzyl)-[(1R)-1-methylpropyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C[NH2+]C(C)CC)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C[NH2+][C@H](C)CC)OC

InChI

InChI=1S/C16H27NO2/c1-5-7-10-19-16-11-14(8-9-15(16)18-4)12-17-13(3)6-2/h8-9,11,13,17H,5-7,10,12H2,1-4H3/p+1/t13-/m1/s1