dipotassium (3S)-4-[[(2S)-1-oxidanidyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-3-(phenylcarbamoylamino)butanoate

Systemtic Name: dipotassium (3S)-4-[[(2S)-1-oxidanidyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-3-(phenylcarbamoylamino)butanoate Openeye Name: dipotassium (3S)-4-[[(1S)-1-benzyl-2-oxido-2-oxo-ethyl]amino]-4-oxo-3-(phenylcarbamoylamino)butanoate CAS Name: dipotassium (3S)-3-[[anilino(oxo)methyl]amino]-4-[[(2S)-1-oxido-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoate IUPAC Name: dipotassium (3S)-4-[[(2S)-1-oxido-1-oxo-3-phenylpropan-2-yl]amino]-4-oxo-3-(phenylcarbamoylamino)butanoate Traditional Name: dipotassium (3S)-4-[[(1S)-1-benzyl-2-keto-2-oxido-ethyl]amino]-4-keto-3-(phenylcarbamoylamino)butyrate Formula: C20H19K2N3O6 MolecularWeight: 475.57796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)C(CC(=O)[O-])NC(=O)NC2=CC=CC=C2.[K+].[K+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)[C@H](CC(=O)[O-])NC(=O)NC2=CC=CC=C2.[K+].[K+]

InChI

InChI=1S/C20H21N3O6.2K/c24-17(25)12-15(23-20(29)21-14-9-5-2-6-10-14)18(26)22-16(19(27)28)11-13-7-3-1-4-8-13;;/h1-10,15-16H,11-12H2,(H,22,26)(H,24,25)(H,27,28)(H2,21,23,29);;/q;2*+1/p-2/t15-,16-;;/m0../s1