[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-propan-2-yl-azanium

Systemtic Name: [(1S)-1-(3,4-dimethoxyphenyl)ethyl]-propan-2-yl-azanium Openeye Name: [(1S)-1-(3,4-dimethoxyphenyl)ethyl]-isopropyl-ammonium CAS Name: [(1S)-1-(3,4-dimethoxyphenyl)ethyl]-propan-2-ylammonium IUPAC Name: [(1S)-1-(3,4-dimethoxyphenyl)ethyl]-propan-2-ylazanium Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)ethyl]-isopropyl-ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO2/c1-9(2)14-10(3)11-6-7-12(15-4)13(8-11)16-5/h6-10,14H,1-5H3/p+1/t10-/m0/s1