methyl 3-decyl-2-oxidanyl-9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: methyl 3-decyl-2-oxidanyl-9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: methyl 3-decyl-2-hydroxy-9,10-dioxo-anthracene-1-carboxylate CAS Name: 3-decyl-2-hydroxy-9,10-dioxo-1-anthracenecarboxylic acid methyl ester IUPAC Name: methyl 3-decyl-2-hydroxy-9,10-dioxoanthracene-1-carboxylate Traditional Name: 3-decyl-2-hydroxy-9,10-diketo-anthracene-1-carboxylic acid methyl ester Formula: C26H30O5 MolecularWeight: 422.5134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C(=O)OC)O

Isomeric SMILES

CCCCCCCCCCC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C(=O)OC)O

InChI

InChI=1S/C26H30O5/c1-3-4-5-6-7-8-9-10-13-17-16-20-21(22(23(17)27)26(30)31-2)25(29)19-15-12-11-14-18(19)24(20)28/h11-12,14-16,27H,3-10,13H2,1-2H3