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

Systemtic Name: (2R)-2-[[(2R)-2-oxidanyl-3-phenoxy-propyl]azaniumyl]hexanoate Openeye Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxy-propyl]ammonio]hexanoate CAS Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxypropyl]ammonio]hexanoate IUPAC Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxypropyl]azaniumyl]hexanoate Traditional Name: (2R)-2-[[(2R)-2-hydroxy-3-phenoxy-propyl]ammonio]hexanoate Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])[NH2+]CC(COC1=CC=CC=C1)O

Isomeric SMILES

CCCC[C@H](C(=O)[O-])[NH2+]C[C@H](COC1=CC=CC=C1)O

InChI

InChI=1S/C15H23NO4/c1-2-3-9-14(15(18)19)16-10-12(17)11-20-13-7-5-4-6-8-13/h4-8,12,14,16-17H,2-3,9-11H2,1H3,(H,18,19)/t12-,14-/m1/s1