2-[(2S)-5-chloranyl-4,6-dimethyl-2,3-dihydro-1-benzofuran-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-5-chloranyl-4,6-dimethyl-2,3-dihydro-1-benzofuran-2-yl]ethanoic acid Openeye Name: 2-[(2S)-5-chloro-4,6-dimethyl-2,3-dihydrobenzofuran-2-yl]acetic acid CAS Name: 2-[(2S)-5-chloro-4,6-dimethyl-2,3-dihydrobenzofuran-2-yl]acetic acid IUPAC Name: 2-[(2S)-5-chloro-4,6-dimethyl-2,3-dihydro-1-benzofuran-2-yl]acetic acid Traditional Name: 2-[(2S)-5-chloro-4,6-dimethyl-coumaran-2-yl]acetic acid Formula: C12H13ClO3 MolecularWeight: 240.68282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(O2)CC(=O)O)C(=C1Cl)C

Isomeric SMILES

CC1=CC2=C(C[C@H](O2)CC(=O)O)C(=C1Cl)C

InChI

InChI=1S/C12H13ClO3/c1-6-3-10-9(7(2)12(6)13)4-8(16-10)5-11(14)15/h3,8H,4-5H2,1-2H3,(H,14,15)/t8-/m0/s1