tert-butyl 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propanoate

Systemtic Name: tert-butyl 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propanoate Openeye Name: tert-butyl 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propanoate CAS Name: 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propanoate Traditional Name: 2,2-dimethyl-3-[4-[[(E)-tridec-2-enoxy]methyl]phenyl]propionic acid tert-butyl ester Formula: C29H48O3 MolecularWeight: 444.68962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CCOCC1=CC=C(C=C1)CC(C)(C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCC/C=C/COCC1=CC=C(C=C1)CC(C)(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H48O3/c1-7-8-9-10-11-12-13-14-15-16-17-22-31-24-26-20-18-25(19-21-26)23-29(5,6)27(30)32-28(2,3)4/h16-21H,7-15,22-24H2,1-6H3/b17-16+