2-[1-(4-nitrophenyl)sulfonylpropyl]-1,3-dihydroisoindole

Systemtic Name: 2-[1-(4-nitrophenyl)sulfonylpropyl]-1,3-dihydroisoindole Openeye Name: 2-[1-(4-nitrophenyl)sulfonylpropyl]isoindoline CAS Name: 2-[1-(4-nitrophenyl)sulfonylpropyl]-1,3-dihydroisoindole IUPAC Name: 2-[1-(4-nitrophenyl)sulfonylpropyl]-1,3-dihydroisoindole Traditional Name: 2-(1-nosylpropyl)isoindoline Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CC2=CC=CC=C2C1)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(N1CC2=CC=CC=C2C1)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4S/c1-2-17(18-11-13-5-3-4-6-14(13)12-18)24(22,23)16-9-7-15(8-10-16)19(20)21/h3-10,17H,2,11-12H2,1H3