N3-(1,3-benzodioxol-5-ylmethyl)-N1-butyl-5-(4-fluoranyl-3-methyl-phenyl)piperidine-1,3-dicarboxamide

Systemtic Name: N3-(1,3-benzodioxol-5-ylmethyl)-N1-butyl-5-(4-fluoranyl-3-methyl-phenyl)piperidine-1,3-dicarboxamide Openeye Name: N3-(1,3-benzodioxol-5-ylmethyl)-N1-butyl-5-(4-fluoro-3-methyl-phenyl)piperidine-1,3-dicarboxamide CAS Name: N3-(1,3-benzodioxol-5-ylmethyl)-N1-butyl-5-(4-fluoro-3-methylphenyl)piperidine-1,3-dicarboxamide IUPAC Name: 3-N-(1,3-benzodioxol-5-ylmethyl)-1-N-butyl-5-(4-fluoro-3-methylphenyl)piperidine-1,3-dicarboxamide Traditional Name: N-butyl-5-(4-fluoro-3-methyl-phenyl)-N'-piperonyl-piperidine-1,3-dicarboxamide Formula: C26H32FN3O4 MolecularWeight: 469.548383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CC(CC(C1)C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC(=C(C=C4)F)C

Isomeric SMILES

CCCCNC(=O)N1CC(CC(C1)C(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC(=C(C=C4)F)C

InChI

InChI=1S/C26H32FN3O4/c1-3-4-9-28-26(32)30-14-20(19-6-7-22(27)17(2)10-19)12-21(15-30)25(31)29-13-18-5-8-23-24(11-18)34-16-33-23/h5-8,10-11,20-21H,3-4,9,12-16H2,1-2H3,(H,28,32)(H,29,31)