2-[(2S)-2,6,8-trimethyl-4-oxidanylidene-3H-chromen-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-2,6,8-trimethyl-4-oxidanylidene-3H-chromen-2-yl]ethanoic acid Openeye Name: 2-[(2S)-2,6,8-trimethyl-4-oxo-chroman-2-yl]acetic acid CAS Name: 2-[(2S)-2,6,8-trimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]acetic acid IUPAC Name: 2-[(2S)-2,6,8-trimethyl-4-oxo-3H-chromen-2-yl]acetic acid Traditional Name: 2-[(2S)-4-keto-2,6,8-trimethyl-chroman-2-yl]acetic acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)CC(O2)(C)CC(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C[C@@](O2)(C)CC(=O)O)C

InChI

InChI=1S/C14H16O4/c1-8-4-9(2)13-10(5-8)11(15)6-14(3,18-13)7-12(16)17/h4-5H,6-7H2,1-3H3,(H,16,17)/t14-/m0/s1