3-(2-methyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(2-methyl-4-oxidanylidene-8-propyl-3H-chromen-2-yl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(2-methyl-4-oxo-8-propyl-chroman-2-yl)-2-oxo-propanoic acid CAS Name: 3-(2-methyl-4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl)-2-oxopropanoic acid IUPAC Name: 3-(2-methyl-4-oxo-8-propyl-3H-chromen-2-yl)-2-oxopropanoic acid Traditional Name: 2-keto-3-(4-keto-2-methyl-8-propyl-chroman-2-yl)propionic acid Formula: C16H18O5 MolecularWeight: 290.31112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1OC(CC2=O)(C)CC(=O)C(=O)O

Isomeric SMILES

CCCC1=CC=CC2=C1OC(CC2=O)(C)CC(=O)C(=O)O

InChI

InChI=1S/C16H18O5/c1-3-5-10-6-4-7-11-12(17)8-16(2,21-14(10)11)9-13(18)15(19)20/h4,6-7H,3,5,8-9H2,1-2H3,(H,19,20)