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

Systemtic Name: (2S)-2-[2-(6,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]propanoic acid Openeye Name: (2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]propanoic acid CAS Name: (2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]propanoic acid IUPAC Name: (2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid Traditional Name: (2S)-2-[[2-(2-keto-6,7-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]propionic acid Formula: C17H19NO7 MolecularWeight: 349.33526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)NC(C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)N[C@@H](C)C(=O)O

InChI

InChI=1S/C17H19NO7/c1-8-10-5-13(23-3)14(24-4)7-12(10)25-17(22)11(8)6-15(19)18-9(2)16(20)21/h5,7,9H,6H2,1-4H3,(H,18,19)(H,20,21)/t9-/m0/s1