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

Systemtic Name: 2-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]pentanoic acid Openeye Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]pentanoic acid CAS Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]pentanoic acid IUPAC Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]pentanoic acid Traditional Name: 2-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]valeric acid Formula: C17H19NO7 MolecularWeight: 349.33526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO7/c1-3-4-11(16(22)23)18-14(21)7-10-8(2)15-12(20)5-9(19)6-13(15)25-17(10)24/h5-6,11,19-20H,3-4,7H2,1-2H3,(H,18,21)(H,22,23)