N-(2-fluoranyl-5-nitro-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-fluoranyl-5-nitro-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-fluoro-5-nitro-phenyl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-fluoro-5-nitrophenyl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-fluoro-5-nitrophenyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-fluoro-5-nitro-phenyl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C19H20FN3O5S MolecularWeight: 421.442603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)S(=O)(=O)N3CCCCC3

InChI

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