4-fluoranyl-1-methyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid

Systemtic Name: 4-fluoranyl-1-methyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid Openeye Name: 4-fluoro-1-methyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid CAS Name: 4-fluoro-1-methyl-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid IUPAC Name: 4-fluoro-1-methyl-5H-benzo[d][1,3]benzodioxocine-11-carboxylic acid Traditional Name: 4-fluoro-1-methyl-5H-benzo[d][1,3]benzodioxocin-11-carboxylic acid Formula: C16H13FO4 MolecularWeight: 288.270423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)F)CC3=CC=CC=C3OC(O2)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)F)CC3=CC=CC=C3OC(O2)C(=O)O

InChI

InChI=1S/C16H13FO4/c1-9-6-7-12(17)11-8-10-4-2-3-5-13(10)20-16(15(18)19)21-14(9)11/h2-7,16H,8H2,1H3,(H,18,19)