4-chloranylbutan-2-yl octadecanoate

Systemtic Name: 4-chloranylbutan-2-yl octadecanoate Openeye Name: (3-chloro-1-methyl-propyl) octadecanoate CAS Name: octadecanoic acid 4-chlorobutan-2-yl ester IUPAC Name: 4-chlorobutan-2-yl octadecanoate Traditional Name: stearic acid (3-chloro-1-methyl-propyl) ester Formula: C22H43ClO2 MolecularWeight: 375.02862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(C)CCCl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(C)CCCl

InChI

InChI=1S/C22H43ClO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)25-21(2)19-20-23/h21H,3-20H2,1-2H3