N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[(E)-veratrylideneamino]isonipecotamide Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C22H24FN3O4/c1-29-19-8-3-15(13-20(19)30-2)14-24-25-21(27)16-9-11-26(12-10-16)22(28)17-4-6-18(23)7-5-17/h3-8,13-14,16H,9-12H2,1-2H3,(H,25,27)/b24-14+