(3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: (3,5-dimethoxy-4-oxidanyl-phenyl)methyl-[(2S)-pentan-2-yl]azanium Openeye Name: (4-hydroxy-3,5-dimethoxy-phenyl)methyl-[(1S)-1-methylbutyl]ammonium CAS Name: (4-hydroxy-3,5-dimethoxyphenyl)methyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: (4-hydroxy-3,5-dimethoxyphenyl)methyl-[(2S)-pentan-2-yl]azanium Traditional Name: (4-hydroxy-3,5-dimethoxy-benzyl)-[(1S)-1-methylbutyl]ammonium Formula: C14H24NO3+ MolecularWeight: 254.34526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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