diethyl (2E,3E)-2-(5,5-dimethyl-1-oxidanidyl-2-phenyl-imidazol-4-ylidene)-3-(5,5-dimethyl-1-oxidanylidene-2-phenyl-imidazol-1-ium-4-ylidene)butanedioate

Systemtic Name: diethyl (2E,3E)-2-(5,5-dimethyl-1-oxidanidyl-2-phenyl-imidazol-4-ylidene)-3-(5,5-dimethyl-1-oxidanylidene-2-phenyl-imidazol-1-ium-4-ylidene)butanedioate Openeye Name: diethyl (2E,3E)-2-(5,5-dimethyl-1-oxido-2-phenyl-imidazol-4-ylidene)-3-(5,5-dimethyl-1-oxo-2-phenyl-imidazol-1-ium-4-ylidene)butanedioate CAS Name: (2E,3E)-2-(5,5-dimethyl-1-oxido-2-phenyl-4-imidazolylidene)-3-(5,5-dimethyl-1-oxo-2-phenyl-4-imidazol-1-iumylidene)butanedioic acid diethyl ester IUPAC Name: diethyl (2E,3E)-2-(5,5-dimethyl-1-oxido-2-phenylimidazol-4-ylidene)-3-(5,5-dimethyl-1-oxo-2-phenylimidazol-1-ium-4-ylidene)butanedioate Traditional Name: (2E,3E)-2-(5,5-dimethyl-1-oxido-2-phenyl-2-imidazolin-4-ylidene)-3-(1-keto-5,5-dimethyl-2-phenyl-2-imidazolin-1-ium-4-ylidene)succinic acid diethyl ester Formula: C30H32N4O6 MolecularWeight: 544.59828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C(N(C(=N1)C2=CC=CC=C2)[O-])(C)C)C(=C3C([N+](=O)C(=N3)C4=CC=CC=C4)(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C(=C/1\C(N(C(=N1)C2=CC=CC=C2)[O-])(C)C)/C(=C\3/C([N+](=O)C(=N3)C4=CC=CC=C4)(C)C)/C(=O)OCC

InChI

InChI=1S/C30H32N4O6/c1-7-39-27(35)21(23-29(3,4)33(37)25(31-23)19-15-11-9-12-16-19)22(28(36)40-8-2)24-30(5,6)34(38)26(32-24)20-17-13-10-14-18-20/h9-18H,7-8H2,1-6H3/b23-21+,24-22+