2-oxidanyl-5-[[(2S)-2-oxidanyl-3-phenoxy-propyl]amino]benzoate

Systemtic Name: 2-oxidanyl-5-[[(2S)-2-oxidanyl-3-phenoxy-propyl]amino]benzoate Openeye Name: 2-hydroxy-5-[[(2S)-2-hydroxy-3-phenoxy-propyl]amino]benzoate CAS Name: 2-hydroxy-5-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]benzoate IUPAC Name: 2-hydroxy-5-[[(2S)-2-hydroxy-3-phenoxypropyl]amino]benzoate Traditional Name: 2-hydroxy-5-[[(2S)-2-hydroxy-3-phenoxy-propyl]amino]benzoate Formula: C16H16NO5- MolecularWeight: 302.30194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CNC2=CC(=C(C=C2)O)C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)OC[C@H](CNC2=CC(=C(C=C2)O)C(=O)[O-])O

InChI

InChI=1S/C16H17NO5/c18-12(10-22-13-4-2-1-3-5-13)9-17-11-6-7-15(19)14(8-11)16(20)21/h1-8,12,17-19H,9-10H2,(H,20,21)/p-1/t12-/m0/s1