N-[2-(4-tert-butylphenoxy)ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H31FN2O3/c1-25(2,3)20-6-10-22(11-7-20)31-17-14-27-23(29)18-12-15-28(16-13-18)24(30)19-4-8-21(26)9-5-19/h4-11,18H,12-17H2,1-3H3,(H,27,29)