N-[(2-ethoxyphenyl)methyl]-2-[1-(2-fluoranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-2-[1-(2-fluoranyl-4-nitro-phenyl)carbonylpiperidin-4-yl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-2-[1-(2-fluoro-4-nitro-benzoyl)-4-piperidyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[(2-ethoxyphenyl)methyl]-2-[1-[(2-fluoro-4-nitrophenyl)-oxomethyl]-4-piperidinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-2-[1-(2-fluoro-4-nitrobenzoyl)piperidin-4-yl]-6-methylpyridine-3-carboxamide Traditional Name: N-(2-ethoxybenzyl)-2-[1-(2-fluoro-4-nitro-benzoyl)-4-piperidyl]-6-methyl-nicotinamide Formula: C28H29FN4O5 MolecularWeight: 520.552063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C28H29FN4O5/c1-3-38-25-7-5-4-6-20(25)17-30-27(34)23-10-8-18(2)31-26(23)19-12-14-32(15-13-19)28(35)22-11-9-21(33(36)37)16-24(22)29/h4-11,16,19H,3,12-15,17H2,1-2H3,(H,30,34)