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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 3-nitrobenzenesulfonate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid 2-phthalimidoethyl ester Formula: C16H12N2O7S MolecularWeight: 376.34068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O7S/c19-15-13-6-1-2-7-14(13)16(20)17(15)8-9-25-26(23,24)12-5-3-4-11(10-12)18(21)22/h1-7,10H,8-9H2