[(2S)-1-[[(2S)-3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[(2S)-3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[[(1S)-1-(1H-imidazol-5-ylmethyl)-2-methoxy-2-oxo-ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[(2S)-3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[[(2S)-3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-[[(1S)-1-(1H-imidazol-5-ylmethyl)-2-keto-2-methoxy-ethyl]amino]-2-keto-ethyl]ammonium Formula: C16H21N4O3+ MolecularWeight: 317.36294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=CN1)NC(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

COC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C16H20N4O3/c1-23-16(22)14(8-12-9-18-10-19-12)20-15(21)13(17)7-11-5-3-2-4-6-11/h2-6,9-10,13-14H,7-8,17H2,1H3,(H,18,19)(H,20,21)/p+1/t13-,14-/m0/s1