N-[1-(4,5-dimethoxy-2-nitro-phenyl)carbonylpiperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-(4,5-dimethoxy-2-nitro-phenyl)carbonylpiperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-(4,5-dimethoxy-2-nitro-benzoyl)-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-(4,5-dimethoxy-2-nitrobenzoyl)piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-(4,5-dimethoxy-2-nitro-benzoyl)-4-piperidyl]-4-fluoro-benzamide Formula: C21H22FN3O6 MolecularWeight: 431.414283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])OC

InChI

InChI=1S/C21H22FN3O6/c1-30-18-11-16(17(25(28)29)12-19(18)31-2)21(27)24-9-7-15(8-10-24)23-20(26)13-3-5-14(22)6-4-13/h3-6,11-12,15H,7-10H2,1-2H3,(H,23,26)