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

Systemtic Name: (1S)-1-(4-ethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine Openeye Name: (1S)-1-(4-ethoxyphenyl)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)ethanamine CAS Name: (1S)-1-(4-ethoxyphenyl)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)ethanamine IUPAC Name: (1S)-1-(4-ethoxyphenyl)-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-p-phenetyl-ethyl]amine Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C[N+]2=C(NC=C2)C(C)C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H](C[N+]2=C(NC=C2)C(C)C)N

InChI

InChI=1S/C16H23N3O/c1-4-20-14-7-5-13(6-8-14)15(17)11-19-10-9-18-16(19)12(2)3/h5-10,12,15H,4,11,17H2,1-3H3/p+1/t15-/m1/s1