1-[5-[(2-chlorophenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl hexanoate

Systemtic Name: 1-[5-[(2-chlorophenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl hexanoate Openeye Name: 1-[5-[(2-chlorophenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl hexanoate CAS Name: hexanoic acid 1-[5-[(2-chlorophenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl ester IUPAC Name: 1-[5-[(2-chlorophenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl hexanoate Traditional Name: hexanoic acid 1-[5-(2-chlorobenzyl)oxy-2-propyl-1,3-dioxan-4-yl]ethyl ester Formula: C22H33ClO5 MolecularWeight: 412.94742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(C)C1C(COC(O1)CCC)OCC2=CC=CC=C2Cl

Isomeric SMILES

CCCCCC(=O)OC(C)C1C(COC(O1)CCC)OCC2=CC=CC=C2Cl

InChI

InChI=1S/C22H33ClO5/c1-4-6-7-13-20(24)27-16(3)22-19(15-26-21(28-22)10-5-2)25-14-17-11-8-9-12-18(17)23/h8-9,11-12,16,19,21-22H,4-7,10,13-15H2,1-3H3