(2S)-2-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S)-2-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S)-3-hydroxy-2-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]butanoic acid CAS Name: (2S)-3-hydroxy-2-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-3-hydroxy-2-[(6-nitro-2-oxochromene-3-carbonyl)amino]butanoic acid Traditional Name: (2S)-3-hydroxy-2-[(2-keto-6-nitro-chromene-3-carbonyl)amino]butyric acid Formula: C14H12N2O8 MolecularWeight: 336.25368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O)O

Isomeric SMILES

CC([C@@H](C(=O)O)NC(=O)C1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O)O

InChI

InChI=1S/C14H12N2O8/c1-6(17)11(13(19)20)15-12(18)9-5-7-4-8(16(22)23)2-3-10(7)24-14(9)21/h2-6,11,17H,1H3,(H,15,18)(H,19,20)/t6?,11-/m0/s1