2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-nitrobenzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-nitrobenzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid 2-phthalimidoethyl ester Formula: C17H12N2O6 MolecularWeight: 340.28698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O6/c20-15-13-6-1-2-7-14(13)16(21)18(15)8-9-25-17(22)11-4-3-5-12(10-11)19(23)24/h1-7,10H,8-9H2