O1-(anthracen-9-ylmethyl) O5-(hydroxymethyl) 4-ethyl-2,2-dimethyl-pentanedioate

Systemtic Name: O1-(anthracen-9-ylmethyl) O5-(hydroxymethyl) 4-ethyl-2,2-dimethyl-pentanedioate Openeye Name: O1-(9-anthrylmethyl) O5-(hydroxymethyl) 4-ethyl-2,2-dimethyl-pentanedioate CAS Name: 4-ethyl-2,2-dimethylpentanedioic acid O1-(9-anthracenylmethyl) ester O5-(hydroxymethyl) ester IUPAC Name: 1-O-(anthracen-9-ylmethyl) 5-O-(hydroxymethyl) 4-ethyl-2,2-dimethylpentanedioate Traditional Name: 4-ethyl-2,2-dimethyl-glutaric acid O1-(9-anthrylmethyl) ester O5-methylol ester Formula: C25H28O5 MolecularWeight: 408.48682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(C)C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)C(=O)OCO

Isomeric SMILES

CCC(CC(C)(C)C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)C(=O)OCO

InChI

InChI=1S/C25H28O5/c1-4-17(23(27)30-16-26)14-25(2,3)24(28)29-15-22-20-11-7-5-9-18(20)13-19-10-6-8-12-21(19)22/h5-13,17,26H,4,14-16H2,1-3H3