2-(3,6,8-trimethylpyren-1-yl)propan-2-yl ethanoate

Systemtic Name: 2-(3,6,8-trimethylpyren-1-yl)propan-2-yl ethanoate Openeye Name: [1-methyl-1-(3,6,8-trimethylpyren-1-yl)ethyl] acetate CAS Name: acetic acid 2-(3,6,8-trimethyl-1-pyrenyl)propan-2-yl ester IUPAC Name: 2-(3,6,8-trimethylpyren-1-yl)propan-2-yl acetate Traditional Name: acetic acid [1-methyl-1-(3,6,8-trimethylpyren-1-yl)ethyl] ester Formula: C24H24O2 MolecularWeight: 344.44616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC3=C(C=C(C4=C3C2=C1C=C4)C)C(C)(C)OC(=O)C)C

Isomeric SMILES

CC1=CC(=C2C=CC3=C(C=C(C4=C3C2=C1C=C4)C)C(C)(C)OC(=O)C)C

InChI

InChI=1S/C24H24O2/c1-13-11-14(2)18-9-10-20-21(24(5,6)26-16(4)25)12-15(3)19-8-7-17(13)22(18)23(19)20/h7-12H,1-6H3