4-[4-(2-methoxycarbonylphenyl)-3-nitro-phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[4-(2-methoxycarbonylphenyl)-3-nitro-phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[4-(2-methoxycarbonylphenyl)-3-nitro-phenyl]-2,4-dioxo-butanoic acid CAS Name: 4-[4-(2-methoxycarbonylphenyl)-3-nitrophenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[4-(2-methoxycarbonylphenyl)-3-nitrophenyl]-2,4-dioxobutanoic acid Traditional Name: 4-[4-(2-carbomethoxyphenyl)-3-nitro-phenyl]-2,4-diketo-butyric acid Formula: C18H13NO8 MolecularWeight: 371.29772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=C(C=C(C=C2)C(=O)CC(=O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=C(C=C(C=C2)C(=O)CC(=O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H13NO8/c1-27-18(24)13-5-3-2-4-11(13)12-7-6-10(8-14(12)19(25)26)15(20)9-16(21)17(22)23/h2-8H,9H2,1H3,(H,22,23)