(2S)-2-[(3-nitrophenyl)carbamoylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[(3-nitrophenyl)carbamoylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-3-hydroxy-2-[(3-nitrophenyl)carbamoylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[[(3-nitroanilino)-oxomethyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[(3-nitrophenyl)carbamoylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(3-nitrophenyl)carbamoylamino]propionate Formula: C10H10N3O6- MolecularWeight: 268.2029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C10H11N3O6/c14-5-8(9(15)16)12-10(17)11-6-2-1-3-7(4-6)13(18)19/h1-4,8,14H,5H2,(H,15,16)(H2,11,12,17)/p-1/t8-/m0/s1