(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-azanium

Systemtic Name: (2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-azanium Openeye Name: (2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-ammonium CAS Name: (2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methyl-3-piperidin-1-iumyl]methyl]-phenethylammonium IUPAC Name: (2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethylazanium Traditional Name: (2-ethyl-5-methyl-1H-imidazol-4-yl)methyl-[[(3S)-1-methylpiperidin-1-ium-3-yl]methyl]-phenethyl-ammonium Formula: C22H36N4+2 MolecularWeight: 356.54804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)C[NH+](CCC2=CC=CC=C2)CC3CCC[NH+](C3)C

Isomeric SMILES

CCC1=NC(=C(N1)C)C[NH+](CCC2=CC=CC=C2)C[C@H]3CCC[NH+](C3)C

InChI

InChI=1S/C22H34N4/c1-4-22-23-18(2)21(24-22)17-26(14-12-19-9-6-5-7-10-19)16-20-11-8-13-25(3)15-20/h5-7,9-10,20H,4,8,11-17H2,1-3H3,(H,23,24)/p+2/t20-/m0/s1