(2E)-2-[[4-(furan-2-ylcarbonyl)pyridin-3-yl]-piperidin-1-yl-methylidene]hexanamide

Systemtic Name: (2E)-2-[[4-(furan-2-ylcarbonyl)pyridin-3-yl]-piperidin-1-yl-methylidene]hexanamide Openeye Name: (2E)-2-[[4-(furan-2-carbonyl)-3-pyridyl]-(1-piperidyl)methylene]hexanamide CAS Name: (2E)-2-[[4-[2-furanyl(oxo)methyl]-3-pyridinyl]-(1-piperidinyl)methylidene]hexanamide IUPAC Name: (2E)-2-[[4-(furan-2-carbonyl)pyridin-3-yl]-piperidin-1-ylmethylidene]hexanamide Traditional Name: (E)-2-butyl-3-[4-(2-furoyl)-3-pyridyl]-3-piperidino-acrylamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C1=C(C=CN=C1)C(=O)C2=CC=CO2)N3CCCCC3)C(=O)N

Isomeric SMILES

CCCC/C(=C(/C1=C(C=CN=C1)C(=O)C2=CC=CO2)\N3CCCCC3)/C(=O)N

InChI

InChI=1S/C22H27N3O3/c1-2-3-8-17(22(23)27)20(25-12-5-4-6-13-25)18-15-24-11-10-16(18)21(26)19-9-7-14-28-19/h7,9-11,14-15H,2-6,8,12-13H2,1H3,(H2,23,27)/b20-17+