(8-acetyloxy-2,7-ditert-butyl-pyren-1-yl) ethanoate

Systemtic Name: (8-acetyloxy-2,7-ditert-butyl-pyren-1-yl) ethanoate Openeye Name: (8-acetoxy-2,7-ditert-butyl-pyren-1-yl) acetate CAS Name: acetic acid (8-acetyloxy-2,7-ditert-butyl-1-pyrenyl) ester IUPAC Name: (8-acetyloxy-2,7-ditert-butylpyren-1-yl) acetate Traditional Name: acetic acid (8-acetoxy-2,7-ditert-butyl-pyren-1-yl) ester Formula: C28H30O4 MolecularWeight: 430.5354

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C=CC3=CC(=C(C4=C3C2=C1C=C4)OC(=O)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=C2C=CC3=CC(=C(C4=C3C2=C1C=C4)OC(=O)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C28H30O4/c1-15(29)31-25-19-11-12-20-24-18(14-22(28(6,7)8)26(20)32-16(2)30)10-9-17(23(19)24)13-21(25)27(3,4)5/h9-14H,1-8H3