4-fluoranyl-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-piperidinosulfonyl-benzamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24FN3O5S/c1-15(16-7-6-8-18(13-16)25(27)28)23(2)21(26)17-9-10-19(22)20(14-17)31(29,30)24-11-4-3-5-12-24/h6-10,13-15H,3-5,11-12H2,1-2H3