1-[(2R)-2,4,4-trimethyl-1-oxidanidyl-3-oxidanyl-5-(4-propoxyphenyl)imidazol-1-ium-2-yl]ethanone

Systemtic Name: 1-[(2R)-2,4,4-trimethyl-1-oxidanidyl-3-oxidanyl-5-(4-propoxyphenyl)imidazol-1-ium-2-yl]ethanone Openeye Name: 1-[(2R)-3-hydroxy-2,4,4-trimethyl-1-oxido-5-(4-propoxyphenyl)imidazol-1-ium-2-yl]ethanone CAS Name: 1-[(2R)-3-hydroxy-2,4,4-trimethyl-1-oxido-5-(4-propoxyphenyl)-2-imidazol-1-iumyl]ethanone IUPAC Name: 1-[(2R)-3-hydroxy-2,4,4-trimethyl-1-oxido-5-(4-propoxyphenyl)imidazol-1-ium-2-yl]ethanone Traditional Name: 1-[(2R)-3-hydroxy-2,4,4-trimethyl-1-oxido-5-(4-propoxyphenyl)-3-imidazolin-1-ium-2-yl]ethanone Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=[N+](C(N(C2(C)C)O)(C)C(=O)C)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=[N+]([C@](N(C2(C)C)O)(C)C(=O)C)[O-]

InChI

InChI=1S/C17H24N2O4/c1-6-11-23-14-9-7-13(8-10-14)15-16(3,4)19(22)17(5,12(2)20)18(15)21/h7-10,22H,6,11H2,1-5H3/t17-/m0/s1