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

Systemtic Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1,4-diethoxy-3,4-bis(oxidanylidene)but-1-en-1-olate Openeye Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1,4-diethoxy-3,4-dioxo-but-1-en-1-olate CAS Name: (E)-2-(2,3-dimethyl-1-benzimidazol-3-iumyl)-1,4-diethoxy-3,4-dioxo-1-buten-1-olate IUPAC Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1,4-diethoxy-3,4-dioxobut-1-en-1-olate Traditional Name: (E)-2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1,4-diethoxy-3,4-diketo-but-1-en-1-olate Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C(=O)OCC)N1C(=[N+](C2=CC=CC=C21)C)C)[O-]

Isomeric SMILES

CCO/C(=C(\C(=O)C(=O)OCC)/N1C(=[N+](C2=CC=CC=C21)C)C)/[O-]

InChI

InChI=1S/C17H20N2O5/c1-5-23-16(21)14(15(20)17(22)24-6-2)19-11(3)18(4)12-9-7-8-10-13(12)19/h7-10H,5-6H2,1-4H3