2-[6-[6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]naphthalen-2-yl]oxyethanoic acid

Systemtic Name: 2-[6-[6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]naphthalen-2-yl]oxyethanoic acid Openeye Name: 2-[[6-[6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]-2-naphthyl]oxy]acetic acid CAS Name: 2-[[6-[6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]-2-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[6-[6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]naphthalen-2-yl]oxyacetic acid Traditional Name: 2-[6-[4-keto-6-(4-nitrophenyl)-1H-pyrimidin-2-yl]-2-naphthoxy]acetic acid Formula: C22H15N3O6 MolecularWeight: 417.371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=O)N=C(N2)C3=CC4=C(C=C3)C=C(C=C4)OCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=O)N=C(N2)C3=CC4=C(C=C3)C=C(C=C4)OCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O6/c26-20-11-19(13-3-6-17(7-4-13)25(29)30)23-22(24-20)16-2-1-15-10-18(31-12-21(27)28)8-5-14(15)9-16/h1-11H,12H2,(H,27,28)(H,23,24,26)