ethyl 4,5-diphenyl-2-(1-phenylethylamino)-4,5-dihydro-1H-imidazol-3-ium-3-carboxylate

Systemtic Name: ethyl 4,5-diphenyl-2-(1-phenylethylamino)-4,5-dihydro-1H-imidazol-3-ium-3-carboxylate Openeye Name: ethyl 4,5-diphenyl-2-(1-phenylethylamino)-4,5-dihydro-1H-imidazol-3-ium-3-carboxylate CAS Name: 4,5-diphenyl-2-(1-phenylethylamino)-4,5-dihydro-1H-imidazol-3-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4,5-diphenyl-2-(1-phenylethylamino)-4,5-dihydro-1H-imidazol-3-ium-3-carboxylate Traditional Name: 4,5-diphenyl-2-(1-phenylethylamino)-2-imidazolin-1-ium-1-carboxylic acid ethyl ester Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O2/c1-3-31-26(30)29-24(22-17-11-6-12-18-22)23(21-15-9-5-10-16-21)28-25(29)27-19(2)20-13-7-4-8-14-20/h4-19,23-24H,3H2,1-2H3,(H,27,28)/p+1