(2S)-2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoic acid

Systemtic Name: (2S)-2-(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoic acid Openeye Name: (2S)-2-(6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl)oxypropanoic acid CAS Name: (2S)-2-[(6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]propanoic acid IUPAC Name: (2S)-2-(6-chloro-3,4-dimethyl-2-oxochromen-7-yl)oxypropanoic acid Traditional Name: (2S)-2-(6-chloro-2-keto-3,4-dimethyl-chromen-7-yl)oxypropionic acid Formula: C14H13ClO5 MolecularWeight: 296.70302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClO5/c1-6-7(2)14(18)20-11-5-12(10(15)4-9(6)11)19-8(3)13(16)17/h4-5,8H,1-3H3,(H,16,17)/t8-/m0/s1