2-[2-(6,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]butanoic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO7/c1-5-12(17(21)22)19-16(20)7-11-9(2)10-6-14(24-3)15(25-4)8-13(10)26-18(11)23/h6,8,12H,5,7H2,1-4H3,(H,19,20)(H,21,22)