tridecan-3-yl 3-phenylpropanoate

Systemtic Name: tridecan-3-yl 3-phenylpropanoate Openeye Name: 1-ethylundecyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid tridecan-3-yl ester IUPAC Name: tridecan-3-yl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid 1-ethylundecyl ester Formula: C22H36O2 MolecularWeight: 332.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC)OC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCC(CC)OC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C22H36O2/c1-3-5-6-7-8-9-10-14-17-21(4-2)24-22(23)19-18-20-15-12-11-13-16-20/h11-13,15-16,21H,3-10,14,17-19H2,1-2H3