4-fluoranyl-N-(2-methyl-3-nitro-phenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-(2-methyl-3-nitro-phenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-(2-methyl-3-nitro-phenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-(2-methyl-3-nitrophenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-(2-methyl-3-nitrophenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-(2-methyl-3-nitro-phenyl)-3-piperidinosulfonyl-benzamide Formula: C19H20FN3O5S MolecularWeight: 421.442603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H20FN3O5S/c1-13-16(6-5-7-17(13)23(25)26)21-19(24)14-8-9-15(20)18(12-14)29(27,28)22-10-3-2-4-11-22/h5-9,12H,2-4,10-11H2,1H3,(H,21,24)