N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3,5-dinitro-benzamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3,5-dinitro-benzamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-3,5-dinitro-benzamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-3,5-dinitrobenzamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-3,5-dinitrobenzamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-3,5-dinitro-benzamide Formula: C15H12FN3O5 MolecularWeight: 333.271283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C15H12FN3O5/c1-9-4-10(2-3-14(9)16)8-17-15(20)11-5-12(18(21)22)7-13(6-11)19(23)24/h2-7H,8H2,1H3,(H,17,20)