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

Systemtic Name: 2-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoylamino]butanoic acid Openeye Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]butanoic acid CAS Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]butyric acid Formula: C16H17NO7 MolecularWeight: 335.30868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO7/c1-3-10(15(21)22)17-13(20)6-9-7(2)14-11(19)4-8(18)5-12(14)24-16(9)23/h4-5,10,18-19H,3,6H2,1-2H3,(H,17,20)(H,21,22)