[2-ethanoyl-3-methyl-9,10-bis(oxidanylidene)anthracen-1-yl] (2S)-2-methylbutanoate

Systemtic Name: [2-ethanoyl-3-methyl-9,10-bis(oxidanylidene)anthracen-1-yl] (2S)-2-methylbutanoate Openeye Name: (2-acetyl-3-methyl-9,10-dioxo-1-anthryl) (2S)-2-methylbutanoate CAS Name: (2S)-2-methylbutanoic acid (2-acetyl-3-methyl-9,10-dioxo-1-anthracenyl) ester IUPAC Name: (2-acetyl-3-methyl-9,10-dioxoanthracen-1-yl) (2S)-2-methylbutanoate Traditional Name: (2S)-2-methylbutyric acid (2-acetyl-9,10-diketo-3-methyl-1-anthryl) ester Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=C2C(=CC(=C1C(=O)C)C)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC[C@H](C)C(=O)OC1=C2C(=CC(=C1C(=O)C)C)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H20O5/c1-5-11(2)22(26)27-21-17(13(4)23)12(3)10-16-18(21)20(25)15-9-7-6-8-14(15)19(16)24/h6-11H,5H2,1-4H3/t11-/m0/s1