1-(3-fluorophenyl)carbonyl-N-(2-methoxy-4-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-fluorophenyl)carbonyl-N-(2-methoxy-4-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(3-fluorobenzoyl)-N-(2-methoxy-4-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-[(3-fluorophenyl)-oxomethyl]-N-(2-methoxy-4-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-fluorobenzoyl)-N-(2-methoxy-4-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(3-fluorobenzoyl)-N-(2-methoxy-4-nitro-phenyl)isonipecotamide Formula: C20H20FN3O5 MolecularWeight: 401.388303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H20FN3O5/c1-29-18-12-16(24(27)28)5-6-17(18)22-19(25)13-7-9-23(10-8-13)20(26)14-3-2-4-15(21)11-14/h2-6,11-13H,7-10H2,1H3,(H,22,25)