(2R,3R)-4-azanyl-2,3-bis[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-butanoic acid

Systemtic Name: (2R,3R)-4-azanyl-2,3-bis[(3,4-dimethoxyphenyl)methyl]-4-oxidanylidene-butanoic acid Openeye Name: (2R,3R)-4-amino-2,3-bis[(3,4-dimethoxyphenyl)methyl]-4-oxo-butanoic acid CAS Name: (2R,3R)-4-amino-2,3-bis[(3,4-dimethoxyphenyl)methyl]-4-oxobutanoic acid IUPAC Name: (2R,3R)-4-amino-2,3-bis[(3,4-dimethoxyphenyl)methyl]-4-oxobutanoic acid Traditional Name: (2R,3R)-4-amino-4-keto-2,3-diveratryl-butyric acid Formula: C22H27NO7 MolecularWeight: 417.45228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(C(CC2=CC(=C(C=C2)OC)OC)C(=O)O)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[C@H]([C@@H](CC2=CC(=C(C=C2)OC)OC)C(=O)O)C(=O)N)OC

InChI

InChI=1S/C22H27NO7/c1-27-17-7-5-13(11-19(17)29-3)9-15(21(23)24)16(22(25)26)10-14-6-8-18(28-2)20(12-14)30-4/h5-8,11-12,15-16H,9-10H2,1-4H3,(H2,23,24)(H,25,26)/t15-,16-/m1/s1