N-[(E)-(4-methoxyphenyl)methylideneamino]-1-phenacyl-pyridin-1-ium-3-carboxamide bromide

Systemtic Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Openeye Name: N-[(E)-(4-methoxyphenyl)methyleneamino]-1-phenacyl-pyridin-1-ium-3-carboxamide bromide CAS Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-1-phenacyl-3-pyridin-1-iumcarboxamide bromide IUPAC Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-1-phenacylpyridin-1-ium-3-carboxamide bromide Traditional Name: N-[(E)-p-anisylideneamino]-1-phenacyl-pyridin-1-ium-3-carboxamide bromide Formula: C22H20BrN3O3 MolecularWeight: 454.3165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O3.BrH/c1-28-20-11-9-17(10-12-20)14-23-24-22(27)19-8-5-13-25(15-19)16-21(26)18-6-3-2-4-7-18;/h2-15H,16H2,1H3;1H/b23-14+;