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

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[2-[(2-nitrophenyl)amino]ethyl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[2-(2-nitroanilino)ethyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[2-(2-nitroanilino)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[2-(2-nitroanilino)ethyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[2-(2-nitroanilino)ethyl]isonipecotamide Formula: C21H23FN4O4 MolecularWeight: 414.430123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN4O4/c22-17-7-5-16(6-8-17)21(28)25-13-9-15(10-14-25)20(27)24-12-11-23-18-3-1-2-4-19(18)26(29)30/h1-8,15,23H,9-14H2,(H,24,27)