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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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