3-[1-[(E)-3-(furan-2-yl)prop-2-enyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 3-[1-[(E)-3-(furan-2-yl)prop-2-enyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 3-[1-[(E)-3-(2-furyl)allyl]piperidin-1-ium-4-yl]oxy-N-(3-pyridylmethyl)benzamide CAS Name: 3-[[1-[(E)-3-(2-furanyl)prop-2-enyl]-4-piperidin-1-iumyl]oxy]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 3-[1-[(E)-3-(furan-2-yl)prop-2-enyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 3-[1-[(E)-3-(2-furyl)allyl]piperidin-1-ium-4-yl]oxy-N-(3-pyridylmethyl)benzamide Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCC3=CN=CC=C3)CC=CC4=CC=CO4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCC3=CN=CC=C3)C/C=C/C4=CC=CO4

InChI

InChI=1S/C25H27N3O3/c29-25(27-19-20-5-2-12-26-18-20)21-6-1-7-24(17-21)31-23-10-14-28(15-11-23)13-3-8-22-9-4-16-30-22/h1-9,12,16-18,23H,10-11,13-15,19H2,(H,27,29)/p+1/b8-3+