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

Systemtic Name: (1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propylphenyl)ethanamine Openeye Name: (1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-(4-propylphenyl)ethanamine CAS Name: (1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propylphenyl)ethanamine IUPAC Name: (1S)-2-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)-1-(4-propylphenyl)ethanamine Traditional Name: [(1S)-2-(2-isopropyl-1H-imidazol-3-ium-3-yl)-1-(4-propylphenyl)ethyl]amine Formula: C17H26N3+ MolecularWeight: 272.40844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C[N+]2=C(NC=C2)C(C)C)N

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](C[N+]2=C(NC=C2)C(C)C)N

InChI

InChI=1S/C17H25N3/c1-4-5-14-6-8-15(9-7-14)16(18)12-20-11-10-19-17(20)13(2)3/h6-11,13,16H,4-5,12,18H2,1-3H3/p+1/t16-/m1/s1