(4Z)-2-azanyl-4-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one

Systemtic Name: (4Z)-2-azanyl-4-[(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Openeye Name: (4Z)-2-amino-4-[(3-bromo-5-ethoxy-4-hydroxy-phenyl)methylene]-3-methyl-1H-imidazol-3-ium-5-one CAS Name: (4Z)-2-amino-4-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one IUPAC Name: (4Z)-2-amino-4-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-3-methyl-1H-imidazol-3-ium-5-one Traditional Name: (5Z)-2-amino-5-(3-bromo-5-ethoxy-4-hydroxy-benzylidene)-1-methyl-2-imidazolin-1-ium-4-one Formula: C13H15BrN3O3+ MolecularWeight: 341.1805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=[N+]2C)N)Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)NC(=[N+]2C)N)Br)O

InChI

InChI=1S/C13H14BrN3O3/c1-3-20-10-6-7(4-8(14)11(10)18)5-9-12(19)16-13(15)17(9)2/h4-6H,3H2,1-2H3,(H3,15,16,18,19)/p+1