1-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(2,4-dimethylanilino)-2-oxo-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide CAS Name: 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-N-(3-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(2,4-dimethylanilino)-2-keto-ethyl]-N-(3-fluorophenyl)isonipecotamide Formula: C22H26FN3O2 MolecularWeight: 383.459143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)F)C

InChI

InChI=1S/C22H26FN3O2/c1-15-6-7-20(16(2)12-15)25-21(27)14-26-10-8-17(9-11-26)22(28)24-19-5-3-4-18(23)13-19/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,24,28)(H,25,27)