N,2,2-triphenyl-N-(pyridin-1-ium-3-ylmethyl)ethanamide chloride

Systemtic Name: N,2,2-triphenyl-N-(pyridin-1-ium-3-ylmethyl)ethanamide chloride Openeye Name: N,2,2-triphenyl-N-(pyridin-1-ium-3-ylmethyl)acetamide chloride CAS Name: N,2,2-triphenyl-N-(3-pyridin-1-iumylmethyl)acetamide chloride IUPAC Name: N,2,2-triphenyl-N-(pyridin-1-ium-3-ylmethyl)acetamide chloride Traditional Name: N,2,2-triphenyl-N-(pyridin-1-ium-3-ylmethyl)acetamide chloride Formula: C26H23ClN2O MolecularWeight: 414.92662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N(CC3=C[NH+]=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N(CC3=C[NH+]=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C26H22N2O.ClH/c29-26(25(22-12-4-1-5-13-22)23-14-6-2-7-15-23)28(24-16-8-3-9-17-24)20-21-11-10-18-27-19-21;/h1-19,25H,20H2;1H