N-(4-methoxyphenyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide

Systemtic Name: N-(4-methoxyphenyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Openeye Name: N-(4-methoxyphenyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide CAS Name: N-(4-methoxyphenyl)-1-phenacyl-3-pyridin-1-iumcarboxamide bromide IUPAC Name: N-(4-methoxyphenyl)-1-phenacylpyridin-1-ium-3-carboxamide bromide Traditional Name: N-(4-methoxyphenyl)-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Formula: C21H19BrN2O3 MolecularWeight: 427.29116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H18N2O3.BrH/c1-26-19-11-9-18(10-12-19)22-21(25)17-8-5-13-23(14-17)15-20(24)16-6-3-2-4-7-16;/h2-14H,15H2,1H3;1H