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

Systemtic Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]-propan-2-yl-azanium Openeye Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium CAS Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-propan-2-ylammonium IUPAC Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-propan-2-ylazanium Traditional Name: [(2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-isopropyl-ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO3/c1-9(2)14-8-11(15)10-5-6-12(16-3)13(7-10)17-4/h5-7,9,11,14-15H,8H2,1-4H3/p+1/t11-/m1/s1