N'-(4-fluoranyl-3-nitro-phenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(4-fluoranyl-3-nitro-phenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(4-fluoro-3-nitro-phenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(4-fluoro-3-nitrophenyl)-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(4-fluoro-3-nitrophenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(4-fluoro-3-nitro-phenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C20H22FN5O4 MolecularWeight: 415.418183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])CC3=CC=NC=C3

Isomeric SMILES

C1CN(CCC1CNC(=O)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])CC3=CC=NC=C3

InChI

InChI=1S/C20H22FN5O4/c21-17-2-1-16(11-18(17)26(29)30)24-20(28)19(27)23-12-14-5-9-25(10-6-14)13-15-3-7-22-8-4-15/h1-4,7-8,11,14H,5-6,9-10,12-13H2,(H,23,27)(H,24,28)