(1S)-1-(2-methoxy-5-methyl-phenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine

Systemtic Name: (1S)-1-(2-methoxy-5-methyl-phenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine Openeye Name: (1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-(2-methoxy-5-methyl-phenyl)ethanamine CAS Name: (1S)-1-(2-methoxy-5-methylphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine IUPAC Name: (1S)-1-(2-methoxy-5-methylphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine Traditional Name: [(1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-(2-methoxy-5-methyl-phenyl)ethyl]amine Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C[N+]2=C(NC=C2)C(C)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@@H](C[N+]2=C(NC=C2)C(C)C)N

InChI

InChI=1S/C16H23N3O/c1-11(2)16-18-7-8-19(16)10-14(17)13-9-12(3)5-6-15(13)20-4/h5-9,11,14H,10,17H2,1-4H3/p+1/t14-/m1/s1