(2R,3S)-2-[(3,4-dimethoxyphenyl)carbonylamino]-3-oxidanyl-butanoate

Systemtic Name: (2R,3S)-2-[(3,4-dimethoxyphenyl)carbonylamino]-3-oxidanyl-butanoate Openeye Name: (2R,3S)-2-[(3,4-dimethoxybenzoyl)amino]-3-hydroxy-butanoate CAS Name: (2R,3S)-2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-3-hydroxybutanoate IUPAC Name: (2R,3S)-2-[(3,4-dimethoxybenzoyl)amino]-3-hydroxybutanoate Traditional Name: (2R,3S)-3-hydroxy-2-(veratroylamino)butyrate Formula: C13H16NO6- MolecularWeight: 282.26924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1=CC(=C(C=C1)OC)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO6/c1-7(15)11(13(17)18)14-12(16)8-4-5-9(19-2)10(6-8)20-3/h4-7,11,15H,1-3H3,(H,14,16)(H,17,18)/p-1/t7-,11+/m0/s1