[(2S)-1-methoxy-1-oxidanylidene-3-[1-(phenylmethyl)imidazol-4-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-methoxy-1-oxidanylidene-3-[1-(phenylmethyl)imidazol-4-yl]propan-2-yl]azanium Openeye Name: [(1S)-1-[(1-benzylimidazol-4-yl)methyl]-2-methoxy-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-methoxy-1-oxo-3-[1-(phenylmethyl)-4-imidazolyl]propan-2-yl]ammonium IUPAC Name: [(2S)-3-(1-benzylimidazol-4-yl)-1-methoxy-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-1-[(1-benzylimidazol-4-yl)methyl]-2-keto-2-methoxy-ethyl]ammonium Formula: C14H18N3O2+ MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

COC(=O)[C@H](CC1=CN(C=N1)CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C14H17N3O2/c1-19-14(18)13(15)7-12-9-17(10-16-12)8-11-5-3-2-4-6-11/h2-6,9-10,13H,7-8,15H2,1H3/p+1/t13-/m0/s1