N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C21H21BrFN3O3 MolecularWeight: 462.312143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21BrFN3O3/c22-17-3-1-2-4-18(17)25-19(27)13-24-20(28)14-9-11-26(12-10-14)21(29)15-5-7-16(23)8-6-15/h1-8,14H,9-13H2,(H,24,28)(H,25,27)