2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[(3-fluorobenzyl)-methyl-amino]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H14FN3O4 MolecularWeight: 343.309163

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14FN3O4/c1-19(9-11-4-2-5-12(18)8-11)10-20-16(22)13-6-3-7-14(21(24)25)15(13)17(20)23/h2-8H,9-10H2,1H3