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

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-(4-fluoro-3-nitrophenyl)-1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-1-methyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C17H19FN4O5S MolecularWeight: 410.419963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H19FN4O5S/c1-20-11-13(28(26,27)21-7-3-2-4-8-21)10-16(20)17(23)19-12-5-6-14(18)15(9-12)22(24)25/h5-6,9-11H,2-4,7-8H2,1H3,(H,19,23)