7-bromanyl-4-[(3-methylimidazol-3-ium-1-yl)methyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[(3-methylimidazol-3-ium-1-yl)methyl]chromen-2-one Openeye Name: 7-bromo-4-[(3-methylimidazol-3-ium-1-yl)methyl]chromen-2-one CAS Name: 7-bromo-4-[(3-methyl-1-imidazol-3-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[(3-methylimidazol-3-ium-1-yl)methyl]chromen-2-one Traditional Name: 7-bromo-4-[(3-methylimidazol-3-ium-1-yl)methyl]coumarin Formula: C14H12BrN2O2+ MolecularWeight: 320.16128

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

C[N+]1=CN(C=C1)CC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C14H12BrN2O2/c1-16-4-5-17(9-16)8-10-6-14(18)19-13-7-11(15)2-3-12(10)13/h2-7,9H,8H2,1H3/q+1