1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoranyl-3-nitro-phenyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoro-3-nitro-phenyl)piperidine-4-carboxamide CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoro-3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoro-3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(4-fluoro-3-nitro-phenyl)isonipecotamide Formula: C20H22FN3O7S MolecularWeight: 467.467983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22FN3O7S/c1-30-18-6-4-15(12-19(18)31-2)32(28,29)23-9-7-13(8-10-23)20(25)22-14-3-5-16(21)17(11-14)24(26)27/h3-6,11-13H,7-10H2,1-2H3,(H,22,25)