[(10bS,10cR)-4,9-bis(bromanyl)-7-tert-butyl-10b,10c-dimethyl-pyren-2-yl]-pyren-1-yl-methanone

Systemtic Name: [(10bS,10cR)-4,9-bis(bromanyl)-7-tert-butyl-10b,10c-dimethyl-pyren-2-yl]-pyren-1-yl-methanone Openeye Name: [(10bS,10cR)-4,9-dibromo-7-tert-butyl-10b,10c-dimethyl-pyren-2-yl]-pyren-1-yl-methanone CAS Name: [(10bS,10cR)-4,9-dibromo-7-tert-butyl-10b,10c-dimethyl-2-pyrenyl]-(1-pyrenyl)methanone IUPAC Name: [(10bS,10cR)-4,9-dibromo-7-tert-butyl-10b,10c-dimethylpyren-2-yl]-pyren-1-ylmethanone Traditional Name: [(10bS,10cR)-4,9-dibromo-7-tert-butyl-10b,10c-dimethyl-pyren-2-yl]-pyren-1-yl-methanone Formula: C39H30Br2O MolecularWeight: 674.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC(=C4C1(C(=CC(=C4)C(C)(C)C)C=C(C2=CC(=C3)C(=O)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)Br)C)Br

Isomeric SMILES

C[C@]12C3=CC(=C4[C@@]1(C(=CC(=C4)C(C)(C)C)C=C(C2=CC(=C3)C(=O)C5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)Br)C)Br

InChI

InChI=1S/C39H30Br2O/c1-37(2,3)25-17-27-20-32(40)30-16-24(15-26-19-33(41)31(18-25)39(27,5)38(26,30)4)36(42)29-14-12-23-10-9-21-7-6-8-22-11-13-28(29)35(23)34(21)22/h6-20H,1-5H3/t38-,39+/m1/s1