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2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]azanium

2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]azanium

Systemtic Name:2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]azanium
Openeye Name:2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]ammonium
CAS Name:2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]ammonium
IUPAC Name:2-(3,4-dimethoxyphenyl)ethyl-[(2S)-2-methylbutyl]azanium
Traditional Name:homoveratryl-[(2S)-2-methylbutyl]ammonium
Formula: C15H26NO2+
MolecularWeight: 252.37244
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[NH2+]CCC1=CC(=C(C=C1)OC)OC


Isomeric SMILES

CC[C@H](C)C[NH2+]CCC1=CC(=C(C=C1)OC)OC


InChI

InChI=1S/C15H25NO2/c1-5-12(2)11-16-9-8-13-6-7-14(17-3)15(10-13)18-4/h6-7,10,12,16H,5,8-9,11H2,1-4H3/p+1/t12-/m0/s1


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