5-[9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoic acid

Systemtic Name: 5-[9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoic acid Openeye Name: 5-(9,10-dioxo-2-anthryl)-5-methyl-hexanoic acid CAS Name: 5-(9,10-dioxo-2-anthracenyl)-5-methylhexanoic acid IUPAC Name: 5-(9,10-dioxoanthracen-2-yl)-5-methylhexanoic acid Traditional Name: 5-(9,10-diketo-2-anthryl)-5-methyl-hexanoic acid Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(CCCC(=O)O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20O4/c1-21(2,11-5-8-18(22)23)13-9-10-16-17(12-13)20(25)15-7-4-3-6-14(15)19(16)24/h3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,22,23)