2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-methyl-2-nitro-benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-methyl-2-nitro-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-methyl-2-nitro-benzoate CAS Name: 3-methyl-2-nitrobenzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-methyl-2-nitrobenzoate Traditional Name: 3-methyl-2-nitro-benzoic acid 2-phthalimidoethyl ester Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H14N2O6/c1-11-5-4-8-14(15(11)20(24)25)18(23)26-10-9-19-16(21)12-6-2-3-7-13(12)17(19)22/h2-8H,9-10H2,1H3