dimethyl-[(2R)-3-methyl-1-[2-[2-(phenoxymethyl)benzimidazol-1-yl]ethanoylamino]butan-2-yl]azanium

Systemtic Name: dimethyl-[(2R)-3-methyl-1-[2-[2-(phenoxymethyl)benzimidazol-1-yl]ethanoylamino]butan-2-yl]azanium Openeye Name: dimethyl-[(1R)-2-methyl-1-[[[2-[2-(phenoxymethyl)benzimidazol-1-yl]acetyl]amino]methyl]propyl]ammonium CAS Name: dimethyl-[(2R)-3-methyl-1-[[1-oxo-2-[2-(phenoxymethyl)-1-benzimidazolyl]ethyl]amino]butan-2-yl]ammonium IUPAC Name: dimethyl-[(2R)-3-methyl-1-[[2-[2-(phenoxymethyl)benzimidazol-1-yl]acetyl]amino]butan-2-yl]azanium Traditional Name: dimethyl-[(1R)-2-methyl-1-[[[2-[2-(phenoxymethyl)benzimidazol-1-yl]acetyl]amino]methyl]propyl]ammonium Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)CN1C2=CC=CC=C2N=C1COC3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)CN1C2=CC=CC=C2N=C1COC3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C23H30N4O2/c1-17(2)21(26(3)4)14-24-23(28)15-27-20-13-9-8-12-19(20)25-22(27)16-29-18-10-6-5-7-11-18/h5-13,17,21H,14-16H2,1-4H3,(H,24,28)/p+1/t21-/m0/s1