3-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]propanoic acid CAS Name: 3-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]propionic acid Formula: C15H15NO7 MolecularWeight: 321.2821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NCCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)NCCC(=O)O

InChI

InChI=1S/C15H15NO7/c1-7-9(6-12(19)16-3-2-13(20)21)15(22)23-11-5-8(17)4-10(18)14(7)11/h4-5,17-18H,2-3,6H2,1H3,(H,16,19)(H,20,21)