ethanedioic acid; N-[(2-fluorophenyl)methyl]-2-methoxy-5-nitro-aniline

Systemtic Name: ethanedioic acid; N-[(2-fluorophenyl)methyl]-2-methoxy-5-nitro-aniline Openeye Name: N-[(2-fluorophenyl)methyl]-2-methoxy-5-nitro-aniline; oxalic acid CAS Name: N-[(2-fluorophenyl)methyl]-2-methoxy-5-nitroaniline; oxalic acid IUPAC Name: N-[(2-fluorophenyl)methyl]-2-methoxy-5-nitroaniline; oxalic acid Traditional Name: (2-fluorobenzyl)-(2-methoxy-5-nitro-phenyl)amine; oxalic acid Formula: C16H15FN2O7 MolecularWeight: 366.297903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=CC=C2F.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=CC=C2F.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H13FN2O3.C2H2O4/c1-20-14-7-6-11(17(18)19)8-13(14)16-9-10-4-2-3-5-12(10)15;3-1(4)2(5)6/h2-8,16H,9H2,1H3;(H,3,4)(H,5,6)