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

Systemtic Name: [(2S)-2-[(3,4-dimethoxyphenyl)methyl]butyl]azanium Openeye Name: [(2S)-2-[(3,4-dimethoxyphenyl)methyl]butyl]ammonium CAS Name: [(2S)-2-[(3,4-dimethoxyphenyl)methyl]butyl]ammonium IUPAC Name: [(2S)-2-[(3,4-dimethoxyphenyl)methyl]butyl]azanium Traditional Name: [(2S)-2-veratrylbutyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=C(C=C1)OC)OC)C[NH3+]

Isomeric SMILES

CC[C@@H](CC1=CC(=C(C=C1)OC)OC)C[NH3+]

InChI

InChI=1S/C13H21NO2/c1-4-10(9-14)7-11-5-6-12(15-2)13(8-11)16-3/h5-6,8,10H,4,7,9,14H2,1-3H3/p+1/t10-/m0/s1