(3R)-3-azaniumyl-3-(2,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (3R)-3-azaniumyl-3-(2,4,5-trimethoxyphenyl)propanoate Openeye Name: (3R)-3-azaniumyl-3-(2,4,5-trimethoxyphenyl)propanoate CAS Name: (3R)-3-ammonio-3-(2,4,5-trimethoxyphenyl)propanoate IUPAC Name: (3R)-3-azaniumyl-3-(2,4,5-trimethoxyphenyl)propanoate Traditional Name: (3R)-3-ammonio-3-asaryl-propionate Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(CC(=O)[O-])[NH3+])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1[C@@H](CC(=O)[O-])[NH3+])OC)OC

InChI

InChI=1S/C12H17NO5/c1-16-9-6-11(18-3)10(17-2)4-7(9)8(13)5-12(14)15/h4,6,8H,5,13H2,1-3H3,(H,14,15)/t8-/m1/s1