methyl (2S)-2,3-bis[[2,3-bis(oxidanyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-2,3-bis[[2,3-bis(oxidanyl)phenyl]carbonylamino]propanoate Openeye Name: methyl (2S)-2,3-bis[(2,3-dihydroxybenzoyl)amino]propanoate CAS Name: (2S)-2,3-bis[[(2,3-dihydroxyphenyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2,3-bis[(2,3-dihydroxybenzoyl)amino]propanoate Traditional Name: (2S)-2,3-bis[(2,3-dihydroxybenzoyl)amino]propionic acid methyl ester Formula: C18H18N2O8 MolecularWeight: 390.34412

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)C1=C(C(=CC=C1)O)O)NC(=O)C2=C(C(=CC=C2)O)O

Isomeric SMILES

COC(=O)[C@H](CNC(=O)C1=C(C(=CC=C1)O)O)NC(=O)C2=C(C(=CC=C2)O)O

InChI

InChI=1S/C18H18N2O8/c1-28-18(27)11(20-17(26)10-5-3-7-13(22)15(10)24)8-19-16(25)9-4-2-6-12(21)14(9)23/h2-7,11,21-24H,8H2,1H3,(H,19,25)(H,20,26)/t11-/m0/s1