[(2S)-2-(2,5-dimethoxyphenyl)butyl]azanium

Systemtic Name: [(2S)-2-(2,5-dimethoxyphenyl)butyl]azanium Openeye Name: [(2S)-2-(2,5-dimethoxyphenyl)butyl]ammonium CAS Name: [(2S)-2-(2,5-dimethoxyphenyl)butyl]ammonium IUPAC Name: [(2S)-2-(2,5-dimethoxyphenyl)butyl]azanium Traditional Name: [(2S)-2-(2,5-dimethoxyphenyl)butyl]ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-4-9(8-13)11-7-10(14-2)5-6-12(11)15-3/h5-7,9H,4,8,13H2,1-3H3/p+1/t9-/m1/s1