2-[(4-fluorophenyl)methylamino]-5-nitro-benzoic acid

Systemtic Name: 2-[(4-fluorophenyl)methylamino]-5-nitro-benzoic acid Openeye Name: 2-[(4-fluorophenyl)methylamino]-5-nitro-benzoic acid CAS Name: 2-[(4-fluorophenyl)methylamino]-5-nitrobenzoic acid IUPAC Name: 2-[(4-fluorophenyl)methylamino]-5-nitrobenzoic acid Traditional Name: 2-[(4-fluorobenzyl)amino]-5-nitro-benzoic acid Formula: C14H11FN2O4 MolecularWeight: 290.246543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)F

InChI

InChI=1S/C14H11FN2O4/c15-10-3-1-9(2-4-10)8-16-13-6-5-11(17(20)21)7-12(13)14(18)19/h1-7,16H,8H2,(H,18,19)