7-(4-methoxy-3-nitro-phenyl)-4,7-bis(oxidanylidene)heptanoic acid

Systemtic Name: 7-(4-methoxy-3-nitro-phenyl)-4,7-bis(oxidanylidene)heptanoic acid Openeye Name: 7-(4-methoxy-3-nitro-phenyl)-4,7-dioxo-heptanoic acid CAS Name: 7-(4-methoxy-3-nitrophenyl)-4,7-dioxoheptanoic acid IUPAC Name: 7-(4-methoxy-3-nitrophenyl)-4,7-dioxoheptanoic acid Traditional Name: 4,7-diketo-7-(4-methoxy-3-nitro-phenyl)enanthic acid Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H15NO7/c1-22-13-6-2-9(8-11(13)15(20)21)12(17)5-3-10(16)4-7-14(18)19/h2,6,8H,3-5,7H2,1H3,(H,18,19)