tert-butyl 3-[3-(tridecoxymethyl)phenyl]propanoate

Systemtic Name: tert-butyl 3-[3-(tridecoxymethyl)phenyl]propanoate Openeye Name: tert-butyl 3-[3-(tridecoxymethyl)phenyl]propanoate CAS Name: 3-[3-(tridecoxymethyl)phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-(tridecoxymethyl)phenyl]propanoate Traditional Name: 3-[3-(tridecoxymethyl)phenyl]propionic acid tert-butyl ester Formula: C27H46O3 MolecularWeight: 418.65234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOCC1=CC=CC(=C1)CCC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCOCC1=CC=CC(=C1)CCC(=O)OC(C)(C)C

InChI

InChI=1S/C27H46O3/c1-5-6-7-8-9-10-11-12-13-14-15-21-29-23-25-18-16-17-24(22-25)19-20-26(28)30-27(2,3)4/h16-18,22H,5-15,19-21,23H2,1-4H3