4-fluoranyl-N-[1-[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-4-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[1-[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-4-yl]benzamide Openeye Name: 4-fluoro-N-[1-[2-(2-methyl-3-nitro-anilino)-2-oxo-ethyl]-4-piperidyl]benzamide CAS Name: 4-fluoro-N-[1-[2-(2-methyl-3-nitroanilino)-2-oxoethyl]-4-piperidinyl]benzamide IUPAC Name: 4-fluoro-N-[1-[2-(2-methyl-3-nitroanilino)-2-oxoethyl]piperidin-4-yl]benzamide Traditional Name: 4-fluoro-N-[1-[2-keto-2-(2-methyl-3-nitro-anilino)ethyl]-4-piperidyl]benzamide Formula: C21H23FN4O4 MolecularWeight: 414.430123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CN2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN4O4/c1-14-18(3-2-4-19(14)26(29)30)24-20(27)13-25-11-9-17(10-12-25)23-21(28)15-5-7-16(22)8-6-15/h2-8,17H,9-13H2,1H3,(H,23,28)(H,24,27)