(phenylmethyl) 5-[9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate

Systemtic Name: (phenylmethyl) 5-[9,10-bis(oxidanylidene)anthracen-2-yl]-5-methyl-hexanoate Openeye Name: benzyl 5-(9,10-dioxo-2-anthryl)-5-methyl-hexanoate CAS Name: 5-(9,10-dioxo-2-anthracenyl)-5-methylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(9,10-dioxoanthracen-2-yl)-5-methylhexanoate Traditional Name: 5-(9,10-diketo-2-anthryl)-5-methyl-hexanoic acid benzyl ester Formula: C28H26O4 MolecularWeight: 426.50364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)OCC1=CC=CC=C1)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(CCCC(=O)OCC1=CC=CC=C1)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H26O4/c1-28(2,16-8-13-25(29)32-18-19-9-4-3-5-10-19)20-14-15-23-24(17-20)27(31)22-12-7-6-11-21(22)26(23)30/h3-7,9-12,14-15,17H,8,13,16,18H2,1-2H3