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

Systemtic Name: 2-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]hexanoic acid Openeye Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]hexanoic acid CAS Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]hexanoic acid Traditional Name: 2-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]hexanoic acid Formula: C18H21NO7 MolecularWeight: 363.36184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2OC1=O)O)O)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2OC1=O)O)O)C

InChI

InChI=1S/C18H21NO7/c1-3-4-5-12(17(23)24)19-15(22)8-11-9(2)16-13(21)6-10(20)7-14(16)26-18(11)25/h6-7,12,20-21H,3-5,8H2,1-2H3,(H,19,22)(H,23,24)