2-(nitromethylsulfonyl)-1,3-dihydroisoindole

Systemtic Name: 2-(nitromethylsulfonyl)-1,3-dihydroisoindole Openeye Name: 2-(nitromethylsulfonyl)isoindoline CAS Name: 2-(nitromethylsulfonyl)-1,3-dihydroisoindole IUPAC Name: 2-(nitromethylsulfonyl)-1,3-dihydroisoindole Traditional Name: 2-(nitromethylsulfonyl)isoindoline Formula: C9H10N2O4S MolecularWeight: 242.2517

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1S(=O)(=O)C[N+](=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2CN1S(=O)(=O)C[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O4S/c12-11(13)7-16(14,15)10-5-8-3-1-2-4-9(8)6-10/h1-4H,5-7H2