ethyl 6-(1-oxidanidyl-3,4,5-triphenyl-2H-imidazol-1-ium-1-yl)hexanoate

Systemtic Name: ethyl 6-(1-oxidanidyl-3,4,5-triphenyl-2H-imidazol-1-ium-1-yl)hexanoate Openeye Name: ethyl 6-(1-oxido-3,4,5-triphenyl-2H-imidazol-1-ium-1-yl)hexanoate CAS Name: 6-(1-oxido-3,4,5-triphenyl-2H-imidazol-1-ium-1-yl)hexanoic acid ethyl ester IUPAC Name: ethyl 6-(1-oxido-3,4,5-triphenyl-2H-imidazol-1-ium-1-yl)hexanoate Traditional Name: 6-(1-oxido-3,4,5-triphenyl-4-imidazolin-1-ium-1-yl)hexanoic acid ethyl ester Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC[N+]1(CN(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CCOC(=O)CCCCC[N+]1(CN(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C29H32N2O3/c1-2-34-27(32)21-13-6-14-22-31(33)23-30(26-19-11-5-12-20-26)28(24-15-7-3-8-16-24)29(31)25-17-9-4-10-18-25/h3-5,7-12,15-20H,2,6,13-14,21-23H2,1H3