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

Systemtic Name: (2R)-2-[2-(5,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]butanoic acid Openeye Name: (2R)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]butanoic acid CAS Name: (2R)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: (2R)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]butanoic acid Traditional Name: (2R)-2-[[2-(2-keto-5,7-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]butyric acid Formula: C18H21NO7 MolecularWeight: 363.36184

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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)OC)OC)C

Isomeric SMILES

CC[C@H](C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2OC1=O)OC)OC)C

InChI

InChI=1S/C18H21NO7/c1-5-12(17(21)22)19-15(20)8-11-9(2)16-13(25-4)6-10(24-3)7-14(16)26-18(11)23/h6-7,12H,5,8H2,1-4H3,(H,19,20)(H,21,22)/t12-/m1/s1