3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide

Systemtic Name: 3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide Openeye Name: 3-[1-(3-furylmethyl)piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide CAS Name: 3-[[1-(3-furanylmethyl)-4-piperidin-1-iumyl]oxy]-N-phenethylbenzamide IUPAC Name: 3-[1-(furan-3-ylmethyl)piperidin-1-ium-4-yl]oxy-N-phenethylbenzamide Traditional Name: 3-[1-(3-furfuryl)piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=C3)CC4=COC=C4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=C3)CC4=COC=C4

InChI

InChI=1S/C25H28N2O3/c28-25(26-13-9-20-5-2-1-3-6-20)22-7-4-8-24(17-22)30-23-10-14-27(15-11-23)18-21-12-16-29-19-21/h1-8,12,16-17,19,23H,9-11,13-15,18H2,(H,26,28)/p+1