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

Systemtic Name: 4-fluoranyl-N-methyl-N-[(3-nitrophenyl)methyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-methyl-N-[(3-nitrophenyl)methyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-methyl-N-[(3-nitrophenyl)methyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-methyl-N-[(3-nitrophenyl)methyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-methyl-N-(3-nitrobenzyl)-3-piperidinosulfonyl-benzamide Formula: C20H22FN3O5S MolecularWeight: 435.469183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN3O5S/c1-22(14-15-6-5-7-17(12-15)24(26)27)20(25)16-8-9-18(21)19(13-16)30(28,29)23-10-3-2-4-11-23/h5-9,12-13H,2-4,10-11,14H2,1H3