2-[(5S,7R)-3-bromanyl-1-adamantyl]isoindole-1,3-dione

Systemtic Name: 2-[(5S,7R)-3-bromanyl-1-adamantyl]isoindole-1,3-dione Openeye Name: 2-[(5S,7R)-3-bromo-1-adamantyl]isoindoline-1,3-dione CAS Name: 2-[(5S,7R)-3-bromo-1-adamantyl]isoindole-1,3-dione IUPAC Name: 2-[(5S,7R)-3-bromo-1-adamantyl]isoindole-1,3-dione Traditional Name: 2-[(5S,7R)-3-bromo-1-adamantyl]isoindoline-1,3-quinone Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Br)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C18H18BrNO2/c19-17-6-11-5-12(7-17)9-18(8-11,10-17)20-15(21)13-3-1-2-4-14(13)16(20)22/h1-4,11-12H,5-10H2/t11-,12+,17?,18?