N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-(pyridin-3-ylmethoxy)benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-4-(pyridin-3-ylmethoxy)benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-(3-pyridylmethoxy)benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-4-(3-pyridinylmethoxy)benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-4-(pyridin-3-ylmethoxy)benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-4-(3-pyridylmethoxy)benzamide Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC=C(C=C2)OCC3=CN=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC=C(C=C2)OCC3=CN=CC=C3)C4=CC=CO4

InChI

InChI=1S/C24H27N3O3/c28-24(20-8-10-21(11-9-20)30-18-19-6-4-12-25-16-19)26-17-22(23-7-5-15-29-23)27-13-2-1-3-14-27/h4-12,15-16,22H,1-3,13-14,17-18H2,(H,26,28)/p+1/t22-/m0/s1