3-(2-azanylprop-2-enoyloxy)-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-(2-azanylprop-2-enoyloxy)-2-[[2,3-bis(oxidanyl)phenyl]carbonylamino]propanoic acid Openeye Name: 3-(2-aminoprop-2-enoyloxy)-2-[(2,3-dihydroxybenzoyl)amino]propanoic acid CAS Name: 3-(2-amino-1-oxoprop-2-enoxy)-2-[[(2,3-dihydroxyphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(2-aminoprop-2-enoyloxy)-2-[(2,3-dihydroxybenzoyl)amino]propanoic acid Traditional Name: 3-(2-aminoacryloyl)oxy-2-[(2,3-dihydroxybenzoyl)amino]propionic acid Formula: C13H14N2O7 MolecularWeight: 310.25946

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)OCC(C(=O)O)NC(=O)C1=C(C(=CC=C1)O)O)N

Isomeric SMILES

C=C(C(=O)OCC(C(=O)O)NC(=O)C1=C(C(=CC=C1)O)O)N

InChI

InChI=1S/C13H14N2O7/c1-6(14)13(21)22-5-8(12(19)20)15-11(18)7-3-2-4-9(16)10(7)17/h2-4,8,16-17H,1,5,14H2,(H,15,18)(H,19,20)