anthracen-9-yl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethyl-pyren-4-yl]methanone

Systemtic Name: anthracen-9-yl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethyl-pyren-4-yl]methanone Openeye Name: 9-anthryl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethyl-pyren-4-yl]methanone CAS Name: 9-anthracenyl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethyl-4-pyrenyl]methanone IUPAC Name: anthracen-9-yl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethylpyren-4-yl]methanone Traditional Name: 9-anthryl-[(10bR,10cR)-2,7-ditert-butyl-10b,10c-dimethyl-pyren-4-yl]methanone Formula: C41H40O MolecularWeight: 548.7557

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC(=CC1=CC(=C4C2(C(=CC(=C4)C(C)(C)C)C=C3)C)C(=O)C5=C6C=CC=CC6=CC7=CC=CC=C75)C(C)(C)C

Isomeric SMILES

C[C@@]12C3=CC(=CC1=CC(=C4[C@]2(C(=CC(=C4)C(C)(C)C)C=C3)C)C(=O)C5=C6C=CC=CC6=CC7=CC=CC=C75)C(C)(C)C

InChI

InChI=1S/C41H40O/c1-38(2,3)29-20-27-17-18-28-21-30(39(4,5)6)24-35-34(23-31(22-29)40(27,7)41(28,35)8)37(42)36-32-15-11-9-13-25(32)19-26-14-10-12-16-33(26)36/h9-24H,1-8H3/t40-,41-/m1/s1