[(2S)-butan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylpropyl]-(3,4,5-trimethoxybenzyl)ammonium Formula: C14H24NO3+ MolecularWeight: 254.34526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC(=C(C(=C1)OC)OC)OC

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=CC(=C(C(=C1)OC)OC)OC

InChI

InChI=1S/C14H23NO3/c1-6-10(2)15-9-11-7-12(16-3)14(18-5)13(8-11)17-4/h7-8,10,15H,6,9H2,1-5H3/p+1/t10-/m0/s1