(3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methyl-N-phenethyl-piperidin-1-ium-3-amine

Systemtic Name: (3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methyl-N-phenethyl-piperidin-1-ium-3-amine Openeye Name: (3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methyl-N-phenethyl-piperidin-1-ium-3-amine CAS Name: (3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methyl-N-phenethyl-3-piperidin-1-iumamine IUPAC Name: (3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methyl-N-phenethylpiperidin-1-ium-3-amine Traditional Name: [(3R)-1-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-yl]-methyl-phenethyl-amine Formula: C22H35N4+ MolecularWeight: 355.5401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)C[NH+]2CCCC(C2)N(C)CCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NC=C(N1)C[NH+]2CCC[C@H](C2)N(C)CCC3=CC=CC=C3

InChI

InChI=1S/C22H34N4/c1-3-4-12-22-23-16-20(24-22)17-26-14-8-11-21(18-26)25(2)15-13-19-9-6-5-7-10-19/h5-7,9-10,16,21H,3-4,8,11-15,17-18H2,1-2H3,(H,23,24)/p+1/t21-/m1/s1