ethanedioic acid; 2-(4-fluorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 2-(4-fluorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine Openeye Name: 2-(4-fluorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid CAS Name: 2-(4-fluorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(4-fluorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid Traditional Name: 2-(4-fluorophenyl)ethyl-(4-nitrobenzyl)amine; oxalic acid Formula: C17H17FN2O6 MolecularWeight: 364.325083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCC2=CC=C(C=C2)[N+](=O)[O-])F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1CCNCC2=CC=C(C=C2)[N+](=O)[O-])F.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H15FN2O2.C2H2O4/c16-14-5-1-12(2-6-14)9-10-17-11-13-3-7-15(8-4-13)18(19)20;3-1(4)2(5)6/h1-8,17H,9-11H2;(H,3,4)(H,5,6)