1-bromanyl-2-tert-butyl-6,8-dimethyl-pyrene

Systemtic Name: 1-bromanyl-2-tert-butyl-6,8-dimethyl-pyrene Openeye Name: 1-bromo-2-tert-butyl-6,8-dimethyl-pyrene CAS Name: 1-bromo-2-tert-butyl-6,8-dimethylpyrene IUPAC Name: 1-bromo-2-tert-butyl-6,8-dimethylpyrene Traditional Name: 1-bromo-2-tert-butyl-6,8-dimethyl-pyrene Formula: C22H21Br MolecularWeight: 365.30614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC3=C4C2=C1C=CC4=CC(=C3Br)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C2C=CC3=C4C2=C1C=CC4=CC(=C3Br)C(C)(C)C)C

InChI

InChI=1S/C22H21Br/c1-12-10-13(2)16-8-9-17-19-14(6-7-15(12)20(16)19)11-18(21(17)23)22(3,4)5/h6-11H,1-5H3