(2S)-3-(7-methoxy-2-methyl-5-oxidanyl-4-oxidanylidene-chromen-6-yl)-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(7-methoxy-2-methyl-5-oxidanyl-4-oxidanylidene-chromen-6-yl)-2-methyl-propanoic acid Openeye Name: (2S)-3-(5-hydroxy-7-methoxy-2-methyl-4-oxo-chromen-6-yl)-2-methyl-propanoic acid CAS Name: (2S)-3-(5-hydroxy-7-methoxy-2-methyl-4-oxo-1-benzopyran-6-yl)-2-methylpropanoic acid IUPAC Name: (2S)-3-(5-hydroxy-7-methoxy-2-methyl-4-oxochromen-6-yl)-2-methylpropanoic acid Traditional Name: (2S)-3-(5-hydroxy-4-keto-7-methoxy-2-methyl-chromen-6-yl)-2-methyl-propionic acid Formula: C15H16O6 MolecularWeight: 292.28394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CC(C)C(=O)O)O

Isomeric SMILES

CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)C[C@H](C)C(=O)O)O

InChI

InChI=1S/C15H16O6/c1-7(15(18)19)4-9-11(20-3)6-12-13(14(9)17)10(16)5-8(2)21-12/h5-7,17H,4H2,1-3H3,(H,18,19)/t7-/m0/s1