N'-(3,4-dimethoxyphenyl)carbonyl-1-(2-fluorophenyl)sulfonyl-piperidine-4-carbohydrazide

Systemtic Name: N'-(3,4-dimethoxyphenyl)carbonyl-1-(2-fluorophenyl)sulfonyl-piperidine-4-carbohydrazide Openeye Name: N'-(3,4-dimethoxybenzoyl)-1-(2-fluorophenyl)sulfonyl-piperidine-4-carbohydrazide CAS Name: N'-[(3,4-dimethoxyphenyl)-oxomethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarbohydrazide IUPAC Name: N'-(3,4-dimethoxybenzoyl)-1-(2-fluorophenyl)sulfonylpiperidine-4-carbohydrazide Traditional Name: 1-(2-fluorophenyl)sulfonyl-N'-veratroyl-isonipecotohydrazide Formula: C21H24FN3O6S MolecularWeight: 465.495163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)OC

InChI

InChI=1S/C21H24FN3O6S/c1-30-17-8-7-15(13-18(17)31-2)21(27)24-23-20(26)14-9-11-25(12-10-14)32(28,29)19-6-4-3-5-16(19)22/h3-8,13-14H,9-12H2,1-2H3,(H,23,26)(H,24,27)