ethyl 2-[[7-nitro-3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]oxy]ethanoate

Systemtic Name: ethyl 2-[[7-nitro-3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]oxy]ethanoate Openeye Name: ethyl 2-(2-benzyl-7-nitro-3-oxo-isoindolin-1-yl)oxyacetate CAS Name: 2-[[7-nitro-3-oxo-2-(phenylmethyl)-1H-isoindol-1-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzyl-7-nitro-3-oxo-1H-isoindol-1-yl)oxy]acetate Traditional Name: 2-(2-benzyl-3-keto-7-nitro-isoindolin-1-yl)oxyacetic acid ethyl ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1C2=C(C=CC=C2[N+](=O)[O-])C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)COC1C2=C(C=CC=C2[N+](=O)[O-])C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O6/c1-2-26-16(22)12-27-19-17-14(9-6-10-15(17)21(24)25)18(23)20(19)11-13-7-4-3-5-8-13/h3-10,19H,2,11-12H2,1H3