1H-inden-2-yl 5,5-bis(2-ethoxy-2-oxidanylidene-ethyl)-3-oxidanidyl-1,2-dihydroimidazol-3-ium-2-carboxylate

Systemtic Name: 1H-inden-2-yl 5,5-bis(2-ethoxy-2-oxidanylidene-ethyl)-3-oxidanidyl-1,2-dihydroimidazol-3-ium-2-carboxylate Openeye Name: 1H-inden-2-yl 5,5-bis(2-ethoxy-2-oxo-ethyl)-3-oxido-1,2-dihydroimidazol-3-ium-2-carboxylate CAS Name: 5,5-bis(2-ethoxy-2-oxoethyl)-3-oxido-1,2-dihydroimidazol-3-ium-2-carboxylic acid 1H-inden-2-yl ester IUPAC Name: 1H-inden-2-yl 5,5-bis(2-ethoxy-2-oxoethyl)-3-oxido-1,2-dihydroimidazol-3-ium-2-carboxylate Traditional Name: 4,4-bis(2-ethoxy-2-keto-ethyl)-1-oxido-3-imidazolin-1-ium-2-carboxylic acid 1H-inden-2-yl ester Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(C=[N+](C(N1)C(=O)OC2=CC3=CC=CC=C3C2)[O-])CC(=O)OCC

Isomeric SMILES

CCOC(=O)CC1(C=[N+](C(N1)C(=O)OC2=CC3=CC=CC=C3C2)[O-])CC(=O)OCC

InChI

InChI=1S/C21H24N2O7/c1-3-28-17(24)11-21(12-18(25)29-4-2)13-23(27)19(22-21)20(26)30-16-9-14-7-5-6-8-15(14)10-16/h5-9,13,19,22H,3-4,10-12H2,1-2H3