tridecan-4-yl 2-phenylethanoate

Systemtic Name: tridecan-4-yl 2-phenylethanoate Openeye Name: 1-propyldecyl 2-phenylacetate CAS Name: 2-phenylacetic acid tridecan-4-yl ester IUPAC Name: tridecan-4-yl 2-phenylacetate Traditional Name: 2-phenylacetic acid 1-propyldecyl ester Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCC)OC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCC(CCC)OC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C21H34O2/c1-3-5-6-7-8-9-13-17-20(14-4-2)23-21(22)18-19-15-11-10-12-16-19/h10-12,15-16,20H,3-9,13-14,17-18H2,1-2H3