4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione

Systemtic Name: 4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Openeye Name: 4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione CAS Name: 4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1-benzopyran-2,5-dione IUPAC Name: 4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-dione Traditional Name: 4-(4-bromophenyl)-7,7-dimethyl-3,4,6,8-tetrahydrochromene-2,5-quinone Formula: C17H17BrO3 MolecularWeight: 349.21908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(CC(=O)O2)C3=CC=C(C=C3)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(CC(=O)O2)C3=CC=C(C=C3)Br)C(=O)C1)C

InChI

InChI=1S/C17H17BrO3/c1-17(2)8-13(19)16-12(7-15(20)21-14(16)9-17)10-3-5-11(18)6-4-10/h3-6,12H,7-9H2,1-2H3