4-(furan-2-yl)-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]benzamide

Systemtic Name: 4-(furan-2-yl)-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]benzamide Openeye Name: 4-(2-furyl)-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]benzamide CAS Name: 4-(2-furanyl)-N-[(3R)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinyl]benzamide IUPAC Name: 4-(furan-2-yl)-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]benzamide Traditional Name: 4-(2-furyl)-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]benzamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCCC(C2)NC(=O)C3=CC=C(C=C3)C4=CC=CO4

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@H](C2)NC(=O)C3=CC=C(C=C3)C4=CC=CO4

InChI

InChI=1S/C22H29N3O2/c1-24-13-10-20(11-14-24)25-12-2-4-19(16-25)23-22(26)18-8-6-17(7-9-18)21-5-3-15-27-21/h3,5-9,15,19-20H,2,4,10-14,16H2,1H3,(H,23,26)/p+1/t19-/m1/s1