1-(furan-3-ylmethyl)-N-[3-(furan-2-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(furan-3-ylmethyl)-N-[3-(furan-2-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-(3-furylmethyl)-N-[3-(2-furyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-(3-furanylmethyl)-N-[3-(2-furanyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(furan-3-ylmethyl)-N-[3-(furan-2-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-furfuryl)-N-[3-(2-furyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC=CO3)CC4=COC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC=CO3)CC4=COC=C4

InChI

InChI=1S/C21H22N2O3/c24-21(17-6-9-23(10-7-17)14-16-8-12-25-15-16)22-19-4-1-3-18(13-19)20-5-2-11-26-20/h1-5,8,11-13,15,17H,6-7,9-10,14H2,(H,22,24)/p+1