2-(2-bromanyl-4-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)ethanamide Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)acetamide CAS Name: 2-(2-bromo-4-methylphenoxy)-N-(4-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-(2-bromo-4-methylphenoxy)-N-(pyridin-1-ium-4-ylmethyl)acetamide Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-N-(pyridin-1-ium-4-ylmethyl)acetamide Formula: C15H16BrN2O2+ MolecularWeight: 336.20374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NCC2=CC=[NH+]C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NCC2=CC=[NH+]C=C2)Br

InChI

InChI=1S/C15H15BrN2O2/c1-11-2-3-14(13(16)8-11)20-10-15(19)18-9-12-4-6-17-7-5-12/h2-8H,9-10H2,1H3,(H,18,19)/p+1