(3,4-dimethoxyphenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(1S,2S)-1,2-dimethylbutyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Traditional Name: [(1S,2S)-1,2-dimethylbutyl]-veratryl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO2/c1-6-11(2)12(3)16-10-13-7-8-14(17-4)15(9-13)18-5/h7-9,11-12,16H,6,10H2,1-5H3/p+1/t11-,12-/m0/s1