[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] anthracene-9-carboxylate

Systemtic Name: [1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] anthracene-9-carboxylate Openeye Name: [2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C26H22O3 MolecularWeight: 382.45108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)C

InChI

InChI=1S/C26H22O3/c1-16-12-13-21(14-17(16)2)25(27)18(3)29-26(28)24-22-10-6-4-8-19(22)15-20-9-5-7-11-23(20)24/h4-15,18H,1-3H3