N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-(3-fluoro-4-methyl-benzyl)-1-(2-nitrophenyl)isonipecotamide Formula: C20H22FN3O3 MolecularWeight: 371.405383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])F

InChI

InChI=1S/C20H22FN3O3/c1-14-6-7-15(12-17(14)21)13-22-20(25)16-8-10-23(11-9-16)18-4-2-3-5-19(18)24(26)27/h2-7,12,16H,8-11,13H2,1H3,(H,22,25)