N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(4-fluorobenzoyl)nipecotamide Formula: C25H32FN3O2 MolecularWeight: 425.538883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)N(C)C

InChI

InChI=1S/C25H32FN3O2/c1-4-18-7-9-19(10-8-18)23(28(2)3)16-27-24(30)21-6-5-15-29(17-21)25(31)20-11-13-22(26)14-12-20/h7-14,21,23H,4-6,15-17H2,1-3H3,(H,27,30)