2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-4-methoxycarbonyl-6-nitro-phenolate

Systemtic Name: 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-4-methoxycarbonyl-6-nitro-phenolate Openeye Name: 2-[(1,3-dioxoisoindolin-2-yl)methyl]-4-methoxycarbonyl-6-nitro-phenolate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methyl]-4-methoxycarbonyl-6-nitrophenolate IUPAC Name: 2-[(1,3-dioxoisoindol-2-yl)methyl]-4-methoxycarbonyl-6-nitrophenolate Traditional Name: 4-carbomethoxy-2-nitro-6-(phthalimidomethyl)phenolate Formula: C17H11N2O7- MolecularWeight: 355.27844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])[O-])CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])[O-])CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H12N2O7/c1-26-17(23)9-6-10(14(20)13(7-9)19(24)25)8-18-15(21)11-4-2-3-5-12(11)16(18)22/h2-7,20H,8H2,1H3/p-1