N-[1-[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperidin-4-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[1-[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonylpiperidin-4-yl]-2-fluoranyl-benzamide Openeye Name: N-[1-[4-(3,5-dimethyl-1-piperidyl)-3-nitro-benzoyl]-4-piperidyl]-2-fluoro-benzamide CAS Name: N-[1-[[4-(3,5-dimethyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]-4-piperidinyl]-2-fluorobenzamide IUPAC Name: N-[1-[4-(3,5-dimethylpiperidin-1-yl)-3-nitrobenzoyl]piperidin-4-yl]-2-fluorobenzamide Traditional Name: N-[1-[4-(3,5-dimethylpiperidino)-3-nitro-benzoyl]-4-piperidyl]-2-fluoro-benzamide Formula: C26H31FN4O4 MolecularWeight: 482.547143

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4F)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4F)[N+](=O)[O-])C

InChI

InChI=1S/C26H31FN4O4/c1-17-13-18(2)16-30(15-17)23-8-7-19(14-24(23)31(34)35)26(33)29-11-9-20(10-12-29)28-25(32)21-5-3-4-6-22(21)27/h3-8,14,17-18,20H,9-13,15-16H2,1-2H3,(H,28,32)