N-(1,3-benzodioxol-5-yl)-3-(5-fluoranyl-2-methoxy-phenyl)carbonyl-piperidine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(5-fluoranyl-2-methoxy-phenyl)carbonyl-piperidine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(5-fluoro-2-methoxy-benzoyl)piperidine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-1-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(5-fluoro-2-methoxybenzoyl)piperidine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(5-fluoro-2-methoxy-benzoyl)piperidine-1-carboxamide Formula: C21H21FN2O5 MolecularWeight: 400.400243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2CCCN(C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2CCCN(C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21FN2O5/c1-27-17-6-4-14(22)9-16(17)20(25)13-3-2-8-24(11-13)21(26)23-15-5-7-18-19(10-15)29-12-28-18/h4-7,9-10,13H,2-3,8,11-12H2,1H3,(H,23,26)