2-[(2R)-1-(2,2-diphenylethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(2-pyridylmethyl)acetamide CAS Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(2-pyridylmethyl)acetamide Formula: C27H31N4O2+ MolecularWeight: 443.56064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=N1)C(=O)CC2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=N1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N4O2/c1-30(19-23-14-8-9-15-28-23)26(32)18-25-27(33)29-16-17-31(25)20-24(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,24-25H,16-20H2,1H3,(H,29,33)/p+1/t25-/m1/s1