4-(2-chloranyl-6-fluoranyl-phenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Openeye Name: 4-(2-chloro-6-fluoro-phenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione CAS Name: 4-(2-chloro-6-fluorophenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1-benzopyran-2,5-dione IUPAC Name: 4-(2-chloro-6-fluorophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Traditional Name: 4-(2-chloro-6-fluoro-phenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-quinone Formula: C17H16ClFO3 MolecularWeight: 322.758543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(CC(=O)O2)C3=C(C=CC=C3Cl)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(CC(=O)O2)C3=C(C=CC=C3Cl)F)C(=O)C1)C

InChI

InChI=1S/C17H16ClFO3/c1-17(2)7-12(20)16-9(6-14(21)22-13(16)8-17)15-10(18)4-3-5-11(15)19/h3-5,9H,6-8H2,1-2H3