(phenylmethyl) 3-(chloromethyl)-4-propyl-benzoate

Systemtic Name: (phenylmethyl) 3-(chloromethyl)-4-propyl-benzoate Openeye Name: benzyl 3-(chloromethyl)-4-propyl-benzoate CAS Name: 3-(chloromethyl)-4-propylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(chloromethyl)-4-propylbenzoate Traditional Name: 3-(chloromethyl)-4-propyl-benzoic acid benzyl ester Formula: C18H19ClO2 MolecularWeight: 302.79526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)CCl

Isomeric SMILES

CCCC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)CCl

InChI

InChI=1S/C18H19ClO2/c1-2-6-15-9-10-16(11-17(15)12-19)18(20)21-13-14-7-4-3-5-8-14/h3-5,7-11H,2,6,12-13H2,1H3