[(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxidanidyl-3,4-dihydropyrrol-1-ium-3-yl]methyl imidazole-1-carboxylate

Systemtic Name: [(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxidanidyl-3,4-dihydropyrrol-1-ium-3-yl]methyl imidazole-1-carboxylate Openeye Name: [(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxido-3,4-dihydropyrrol-1-ium-3-yl]methyl imidazole-1-carboxylate CAS Name: 1-imidazolecarboxylic acid [(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxido-3,4-dihydropyrrol-1-ium-3-yl]methyl ester IUPAC Name: [(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxido-3,4-dihydropyrrol-1-ium-3-yl]methyl imidazole-1-carboxylate Traditional Name: imidazole-1-carboxylic acid [(2R,3R)-2-diethoxyphosphoryl-2-methyl-1-oxido-1-pyrrolin-1-ium-3-yl]methyl ester Formula: C14H22N3O6P MolecularWeight: 359.314741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1(C(CC=[N+]1[O-])COC(=O)N2C=CN=C2)C)OCC

Isomeric SMILES

CCOP(=O)([C@@]1([C@H](CC=[N+]1[O-])COC(=O)N2C=CN=C2)C)OCC

InChI

InChI=1S/C14H22N3O6P/c1-4-22-24(20,23-5-2)14(3)12(6-8-17(14)19)10-21-13(18)16-9-7-15-11-16/h7-9,11-12H,4-6,10H2,1-3H3/t12-,14-/m1/s1