1-bromanyl-7-tert-butyl-3-ethyl-pyrene

Systemtic Name: 1-bromanyl-7-tert-butyl-3-ethyl-pyrene Openeye Name: 1-bromo-7-tert-butyl-3-ethyl-pyrene CAS Name: 1-bromo-7-tert-butyl-3-ethylpyrene IUPAC Name: 1-bromo-7-tert-butyl-3-ethylpyrene Traditional Name: 1-bromo-7-tert-butyl-3-ethyl-pyrene Formula: C22H21Br MolecularWeight: 365.30614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C=CC3=C4C2=C1C=CC4=CC(=C3)C(C)(C)C)Br

Isomeric SMILES

CCC1=CC(=C2C=CC3=C4C2=C1C=CC4=CC(=C3)C(C)(C)C)Br

InChI

InChI=1S/C22H21Br/c1-5-13-12-19(23)18-9-7-15-11-16(22(2,3)4)10-14-6-8-17(13)21(18)20(14)15/h6-12H,5H2,1-4H3