[(1S)-2-(3-imidazol-1-ylpropanoylamino)-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-(3-imidazol-1-ylpropanoylamino)-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(3-imidazol-1-ylpropanoylamino)-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[3-(1-imidazolyl)-1-oxopropyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-(3-imidazol-1-ylpropanoylamino)-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-(3-imidazol-1-ylpropanoylamino)-1-phenyl-ethyl]-dimethyl-ammonium Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCN1C=CN=C1)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CCN1C=CN=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H22N4O/c1-19(2)15(14-6-4-3-5-7-14)12-18-16(21)8-10-20-11-9-17-13-20/h3-7,9,11,13,15H,8,10,12H2,1-2H3,(H,18,21)/p+1/t15-/m1/s1