(2R)-2-[[(2R)-2-oxidanyl-3-phenoxy-propyl]azaniumyl]pentanedioate

Systemtic Name: (2R)-2-[[(2R)-2-oxidanyl-3-phenoxy-propyl]azaniumyl]pentanedioate Openeye Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxy-propyl]ammonio]pentanedioate CAS Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxypropyl]ammonio]pentanedioate IUPAC Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxypropyl]azaniumyl]pentanedioate Traditional Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxy-propyl]ammonio]glutarate Formula: C14H18NO6- MolecularWeight: 296.29582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(C[NH2+]C(CCC(=O)[O-])C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)OC[C@@H](C[NH2+][C@H](CCC(=O)[O-])C(=O)[O-])O

InChI

InChI=1S/C14H19NO6/c16-10(9-21-11-4-2-1-3-5-11)8-15-12(14(19)20)6-7-13(17)18/h1-5,10,12,15-16H,6-9H2,(H,17,18)(H,19,20)/p-1/t10-,12-/m1/s1