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

Systemtic Name: 2-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]butanoic acid CAS Name: 2-[[2-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]butyric acid Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2)O)OC1=O)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2)O)OC1=O)C

InChI

InChI=1S/C16H17NO6/c1-3-12(15(20)21)17-14(19)7-11-8(2)10-5-4-9(18)6-13(10)23-16(11)22/h4-6,12,18H,3,7H2,1-2H3,(H,17,19)(H,20,21)