2-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]butanoic acid

Systemtic Name: 2-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)acetyl]amino]butanoic acid CAS Name: 2-[[2-(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 2-[[2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetyl]amino]butyric acid Formula: C16H17NO6 MolecularWeight: 319.30928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CC1=CC(=O)OC2=C1C=CC(=C2C)O

Isomeric SMILES

CCC(C(=O)O)NC(=O)CC1=CC(=O)OC2=C1C=CC(=C2C)O

InChI

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