tert-butyl 3-[4-(pentadec-2-ynoxymethyl)phenyl]propanoate

Systemtic Name: tert-butyl 3-[4-(pentadec-2-ynoxymethyl)phenyl]propanoate Openeye Name: tert-butyl 3-[4-(pentadec-2-ynoxymethyl)phenyl]propanoate CAS Name: 3-[4-(pentadec-2-ynoxymethyl)phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(pentadec-2-ynoxymethyl)phenyl]propanoate Traditional Name: 3-[4-(pentadec-2-ynoxymethyl)phenyl]propionic acid tert-butyl ester Formula: C29H46O3 MolecularWeight: 442.67374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC#CCOCC1=CC=C(C=C1)CCC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC#CCOCC1=CC=C(C=C1)CCC(=O)OC(C)(C)C

InChI

InChI=1S/C29H46O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-24-31-25-27-20-18-26(19-21-27)22-23-28(30)32-29(2,3)4/h18-21H,5-15,22-25H2,1-4H3