3-(6,8-dimethyl-4-oxidanylidene-chromen-3-yl)propanoic acid

Systemtic Name: 3-(6,8-dimethyl-4-oxidanylidene-chromen-3-yl)propanoic acid Openeye Name: 3-(6,8-dimethyl-4-oxo-chromen-3-yl)propanoic acid CAS Name: 3-(6,8-dimethyl-4-oxo-1-benzopyran-3-yl)propanoic acid IUPAC Name: 3-(6,8-dimethyl-4-oxochromen-3-yl)propanoic acid Traditional Name: 3-(4-keto-6,8-dimethyl-chromen-3-yl)propionic acid Formula: C14H14O4 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=CO2)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=CO2)CCC(=O)O)C

InChI

InChI=1S/C14H14O4/c1-8-5-9(2)14-11(6-8)13(17)10(7-18-14)3-4-12(15)16/h5-7H,3-4H2,1-2H3,(H,15,16)