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

Systemtic Name: 4-benzamido-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-benzamido-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-benzamido-N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-benzamido-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-benzamido-N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzamide Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O3/c29-24(26-18-22(23-10-7-17-31-23)28-15-5-2-6-16-28)20-11-13-21(14-12-20)27-25(30)19-8-3-1-4-9-19/h1,3-4,7-14,17,22H,2,5-6,15-16,18H2,(H,26,29)(H,27,30)/p+1/t22-/m0/s1