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

Systemtic Name: [(2S)-pentan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: [(1S)-1-methylbutyl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: [(2S)-pentan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-pentan-2-yl]-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylbutyl]-(3,4,5-trimethoxybenzyl)ammonium Formula: C15H26NO3+ MolecularWeight: 268.37184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO3/c1-6-7-11(2)16-10-12-8-13(17-3)15(19-5)14(9-12)18-4/h8-9,11,16H,6-7,10H2,1-5H3/p+1/t11-/m0/s1