3-[[(2S,3S)-3-methyl-1-oxidanidyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]benzoate

Systemtic Name: 3-[[(2S,3S)-3-methyl-1-oxidanidyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]benzoate Openeye Name: 3-[[(1S,2S)-1-carboxylato-2-methyl-butyl]carbamoylamino]benzoate CAS Name: 3-[[[[(2S,3S)-3-methyl-1-oxido-1-oxopentan-2-yl]amino]-oxomethyl]amino]benzoate IUPAC Name: 3-[[(2S,3S)-3-methyl-1-oxido-1-oxopentan-2-yl]carbamoylamino]benzoate Traditional Name: 3-[[(1S,2S)-1-carboxylato-2-methyl-butyl]carbamoylamino]benzoate Formula: C14H16N2O5-2 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)NC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)NC1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-3-8(2)11(13(19)20)16-14(21)15-10-6-4-5-9(7-10)12(17)18/h4-8,11H,3H2,1-2H3,(H,17,18)(H,19,20)(H2,15,16,21)/p-2/t8-,11-/m0/s1