(2R)-2-[3-(3-nitrophenyl)-6-oxidanylidene-pyridazin-1-yl]propanoic acid

Systemtic Name: (2R)-2-[3-(3-nitrophenyl)-6-oxidanylidene-pyridazin-1-yl]propanoic acid Openeye Name: (2R)-2-[3-(3-nitrophenyl)-6-oxo-pyridazin-1-yl]propanoic acid CAS Name: (2R)-2-[3-(3-nitrophenyl)-6-oxo-1-pyridazinyl]propanoic acid IUPAC Name: (2R)-2-[3-(3-nitrophenyl)-6-oxopyridazin-1-yl]propanoic acid Traditional Name: (2R)-2-[6-keto-3-(3-nitrophenyl)pyridazin-1-yl]propionic acid Formula: C13H11N3O5 MolecularWeight: 289.24354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=O)C=CC(=N1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)O)N1C(=O)C=CC(=N1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O5/c1-8(13(18)19)15-12(17)6-5-11(14-15)9-3-2-4-10(7-9)16(20)21/h2-8H,1H3,(H,18,19)/t8-/m1/s1