[2,3-bis(fluoranyl)phenyl]methyl 2-(methylamino)-5-nitro-benzoate

Systemtic Name: [2,3-bis(fluoranyl)phenyl]methyl 2-(methylamino)-5-nitro-benzoate Openeye Name: (2,3-difluorophenyl)methyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid (2,3-difluorophenyl)methyl ester IUPAC Name: (2,3-difluorophenyl)methyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid (2,3-difluorobenzyl) ester Formula: C15H12F2N2O4 MolecularWeight: 322.263586

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C(=CC=C2)F)F

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=C(C(=CC=C2)F)F

InChI

InChI=1S/C15H12F2N2O4/c1-18-13-6-5-10(19(21)22)7-11(13)15(20)23-8-9-3-2-4-12(16)14(9)17/h2-7,18H,8H2,1H3