2-[4-[2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]phenoxy]ethanoate

Systemtic Name: 2-[4-[2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]phenoxy]ethanoate Openeye Name: 2-[4-[[2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]amino]phenoxy]acetate CAS Name: 2-[4-[[2-(5-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]phenoxy]acetate IUPAC Name: 2-[4-[[2-(5-nitro-1,3-dioxoisoindol-2-yl)acetyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetyl]amino]phenoxy]acetate Formula: C18H12N3O8- MolecularWeight: 398.30318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OCC(=O)[O-]

InChI

InChI=1S/C18H13N3O8/c22-15(19-10-1-4-12(5-2-10)29-9-16(23)24)8-20-17(25)13-6-3-11(21(27)28)7-14(13)18(20)26/h1-7H,8-9H2,(H,19,22)(H,23,24)/p-1