[(1S)-2-[3-(1H-benzimidazol-2-yl)propanoylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[3-(1H-benzimidazol-2-yl)propanoylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[3-(1H-benzimidazol-2-yl)propanoylamino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[3-(1H-benzimidazol-2-yl)-1-oxopropyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[3-(1H-benzimidazol-2-yl)propanoylamino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[3-(1H-benzimidazol-2-yl)propanoylamino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCC1=NC2=CC=CC=C2N1)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CCC1=NC2=CC=CC=C2N1)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O/c1-24(2)18(15-8-4-3-5-9-15)14-21-20(25)13-12-19-22-16-10-6-7-11-17(16)23-19/h3-11,18H,12-14H2,1-2H3,(H,21,25)(H,22,23)/p+1/t18-/m1/s1