N-[(4-acetamidophenyl)methyl]-2-(4-prop-2-enylmorpholin-4-ium-4-yl)ethanamide bromide

Systemtic Name: N-[(4-acetamidophenyl)methyl]-2-(4-prop-2-enylmorpholin-4-ium-4-yl)ethanamide bromide Openeye Name: N-[(4-acetamidophenyl)methyl]-2-(4-allylmorpholin-4-ium-4-yl)acetamide bromide CAS Name: N-[(4-acetamidophenyl)methyl]-2-(4-prop-2-enyl-4-morpholin-4-iumyl)acetamide bromide IUPAC Name: N-[(4-acetamidophenyl)methyl]-2-(4-prop-2-enylmorpholin-4-ium-4-yl)acetamide bromide Traditional Name: N-(4-acetamidobenzyl)-2-(4-allylmorpholin-4-ium-4-yl)acetamide bromide Formula: C18H26BrN3O3 MolecularWeight: 412.32134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CNC(=O)C[N+]2(CCOCC2)CC=C.[Br-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CNC(=O)C[N+]2(CCOCC2)CC=C.[Br-]

InChI

InChI=1S/C18H25N3O3.BrH/c1-3-8-21(9-11-24-12-10-21)14-18(23)19-13-16-4-6-17(7-5-16)20-15(2)22;/h3-7H,1,8-14H2,2H3,(H-,19,20,22,23);1H