1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[(3-nitrophenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-(3-nitrobenzyl)nipecotamide 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)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O5S/c1-22(13-15-4-2-6-18(12-15)24(26)27)20(25)16-5-3-11-23(14-16)30(28,29)19-9-7-17(21)8-10-19/h2,4,6-10,12,16H,3,5,11,13-14H2,1H3