ethyl (3S)-1-[[(4R)-4-methyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[(4R)-4-methyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[[(4R)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[[(4R)-4-methyl-2,5-dioxo-4-phenyl-1-imidazolidinyl]methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[[(4R)-2,5-diketo-4-methyl-4-phenyl-imidazolidin-1-yl]methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C19H26N3O4+ MolecularWeight: 360.42744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CN2C(=O)C(NC2=O)(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1CCC[NH+](C1)CN2C(=O)[C@@](NC2=O)(C)C3=CC=CC=C3

InChI

InChI=1S/C19H25N3O4/c1-3-26-16(23)14-8-7-11-21(12-14)13-22-17(24)19(2,20-18(22)25)15-9-5-4-6-10-15/h4-6,9-10,14H,3,7-8,11-13H2,1-2H3,(H,20,25)/p+1/t14-,19+/m0/s1