(3aS,7aR)-2-(2-bromanyl-4-methyl-phenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,7aR)-2-(2-bromanyl-4-methyl-phenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,7aR)-2-(2-bromo-4-methyl-phenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,7aR)-2-(2-bromo-4-methylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,7aR)-2-(2-bromo-4-methylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,7aR)-2-(2-bromo-4-methyl-phenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C15H14BrNO2 MolecularWeight: 320.18116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3CC=CCC3C2=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)Br

InChI

InChI=1S/C15H14BrNO2/c1-9-6-7-13(12(16)8-9)17-14(18)10-4-2-3-5-11(10)15(17)19/h2-3,6-8,10-11H,4-5H2,1H3/t10-,11+