2-[4-(3-fluoranyl-4-methyl-5-nitro-phenyl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(3-fluoranyl-4-methyl-5-nitro-phenyl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(3-fluoro-4-methyl-5-nitro-benzoyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[(3-fluoro-4-methyl-5-nitrophenyl)-oxomethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(3-fluoro-4-methyl-5-nitrobenzoyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(3-fluoro-4-methyl-5-nitro-benzoyl)piperazino]acetamide Formula: C21H23FN4O4 MolecularWeight: 414.430123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

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