6-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]hexanoic acid

Systemtic Name: 6-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]hexanoic acid Openeye Name: 6-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]hexanoic acid CAS Name: 6-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]hexanoic acid Traditional Name: 6-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]hexanoic acid Formula: C18H21NO7 MolecularWeight: 363.36184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO7/c1-10-12(9-15(22)19-6-4-2-3-5-16(23)24)18(25)26-14-8-11(20)7-13(21)17(10)14/h7-8,20-21H,2-6,9H2,1H3,(H,19,22)(H,23,24)