2-(dimethylamino)-N-[(3-fluoranyl-4-methyl-phenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[(3-fluoranyl-4-methyl-phenyl)methyl]-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[(3-fluoro-4-methyl-phenyl)methyl]-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[(3-fluoro-4-methylphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[(3-fluoro-4-methylphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-(3-fluoro-4-methyl-benzyl)-5-nitro-benzamide Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18FN3O3/c1-11-4-5-12(8-15(11)18)10-19-17(22)14-9-13(21(23)24)6-7-16(14)20(2)3/h4-9H,10H2,1-3H3,(H,19,22)