4,5,9-tris(bromanyl)-2,7-ditert-butyl-1-chloranyl-pyrene

Systemtic Name: 4,5,9-tris(bromanyl)-2,7-ditert-butyl-1-chloranyl-pyrene Openeye Name: 4,5,9-tribromo-2,7-ditert-butyl-1-chloro-pyrene CAS Name: 4,5,9-tribromo-2,7-ditert-butyl-1-chloropyrene IUPAC Name: 4,5,9-tribromo-2,7-ditert-butyl-1-chloropyrene Traditional Name: 4,5,9-tribromo-2,7-ditert-butyl-1-chloro-pyrene Formula: C24H22Br3Cl MolecularWeight: 585.59648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C3C(=C1)C(=CC4=C3C(=CC(=C4Cl)C(C)(C)C)C(=C2Br)Br)Br

Isomeric SMILES

CC(C)(C)C1=CC2=C3C(=C1)C(=CC4=C3C(=CC(=C4Cl)C(C)(C)C)C(=C2Br)Br)Br

InChI

InChI=1S/C24H22Br3Cl/c1-23(2,3)11-7-12-17(25)10-15-19-14(9-16(22(15)28)24(4,5)6)21(27)20(26)13(8-11)18(12)19/h7-10H,1-6H3