(1S)-1-(3,4-dimethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine

Systemtic Name: (1S)-1-(3,4-dimethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine Openeye Name: (1S)-1-(3,4-dimethoxyphenyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)ethanamine CAS Name: (1S)-1-(3,4-dimethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine IUPAC Name: (1S)-1-(3,4-dimethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)ethyl]amine Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CC(C2=CC(=C(C=C2)OC)OC)N

Isomeric SMILES

CC(C)C1=[N+](C=CN1)C[C@H](C2=CC(=C(C=C2)OC)OC)N

InChI

InChI=1S/C16H23N3O2/c1-11(2)16-18-7-8-19(16)10-13(17)12-5-6-14(20-3)15(9-12)21-4/h5-9,11,13H,10,17H2,1-4H3/p+1/t13-/m1/s1