N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2,2-diphenyl-acetamide CAS Name: N-[(2S)-2-(5-methyl-2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2,2-diphenylacetamide IUPAC Name: N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-ylethyl]-2,2-diphenylacetamide Traditional Name: N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2,2-diphenyl-acetamide Formula: C26H31N2O2+ MolecularWeight: 403.53654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C26H30N2O2/c1-20-15-16-24(30-20)23(28-17-9-4-10-18-28)19-27-26(29)25(21-11-5-2-6-12-21)22-13-7-3-8-14-22/h2-3,5-8,11-16,23,25H,4,9-10,17-19H2,1H3,(H,27,29)/p+1/t23-/m0/s1