1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide Openeye Name: 1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide CAS Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(3-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(3-fluorophenyl)piperidine-4-carboxamide Traditional Name: 1-[2-(3,5-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(=CC(=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)F)C

Isomeric SMILES

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

InChI

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