(E)-2-(3-bromanylquinolin-1-ium-1-yl)-1,4-dimethoxy-3,4-bis(oxidanylidene)but-1-en-1-olate

Systemtic Name: (E)-2-(3-bromanylquinolin-1-ium-1-yl)-1,4-dimethoxy-3,4-bis(oxidanylidene)but-1-en-1-olate Openeye Name: (E)-2-(3-bromoquinolin-1-ium-1-yl)-1,4-dimethoxy-3,4-dioxo-but-1-en-1-olate CAS Name: (E)-2-(3-bromo-1-quinolin-1-iumyl)-1,4-dimethoxy-3,4-dioxo-1-buten-1-olate IUPAC Name: (E)-2-(3-bromoquinolin-1-ium-1-yl)-1,4-dimethoxy-3,4-dioxobut-1-en-1-olate Traditional Name: (E)-2-(3-bromoquinolin-1-ium-1-yl)-3,4-diketo-1,4-dimethoxy-but-1-en-1-olate Formula: C15H12BrNO5 MolecularWeight: 366.16348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)C(=O)OC)[N+]1=CC(=CC2=CC=CC=C21)Br)[O-]

Isomeric SMILES

CO/C(=C(\C(=O)C(=O)OC)/[N+]1=CC(=CC2=CC=CC=C21)Br)/[O-]

InChI

InChI=1S/C15H12BrNO5/c1-21-14(19)12(13(18)15(20)22-2)17-8-10(16)7-9-5-3-4-6-11(9)17/h3-8H,1-2H3