(2R,3R)-2-azaniumyl-3-[3,4-bis(phenylmethoxy)phenyl]-3-oxidanyl-propanoate

Systemtic Name: (2R,3R)-2-azaniumyl-3-[3,4-bis(phenylmethoxy)phenyl]-3-oxidanyl-propanoate Openeye Name: (2R,3R)-2-azaniumyl-3-(3,4-dibenzyloxyphenyl)-3-hydroxy-propanoate CAS Name: (2R,3R)-2-ammonio-3-[3,4-bis(phenylmethoxy)phenyl]-3-hydroxypropanoate IUPAC Name: (2R,3R)-2-azaniumyl-3-[3,4-bis(phenylmethoxy)phenyl]-3-hydroxypropanoate Traditional Name: (2R,3R)-2-ammonio-3-(3,4-dibenzoxyphenyl)-3-hydroxy-propionate Formula: C23H23NO5 MolecularWeight: 393.43242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C(C(=O)[O-])[NH3+])O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[C@H]([C@H](C(=O)[O-])[NH3+])O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H23NO5/c24-21(23(26)27)22(25)18-11-12-19(28-14-16-7-3-1-4-8-16)20(13-18)29-15-17-9-5-2-6-10-17/h1-13,21-22,25H,14-15,24H2,(H,26,27)/t21-,22-/m1/s1