methyl 2-[3-chloranyl-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[3-chloranyl-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]ethanoate Openeye Name: methyl 2-[3-chloro-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]acetate CAS Name: 2-[3-chloro-4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-chloro-4-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]acetate Traditional Name: 2-[3-chloro-4-[3-(4-phenoxy-2-propyl-phenoxy)propoxy]phenyl]acetic acid methyl ester Formula: C27H29ClO5 MolecularWeight: 468.96916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=C(C=C(C=C3)CC(=O)OC)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCOC3=C(C=C(C=C3)CC(=O)OC)Cl

InChI

InChI=1S/C27H29ClO5/c1-3-8-21-19-23(33-22-9-5-4-6-10-22)12-14-25(21)31-15-7-16-32-26-13-11-20(17-24(26)28)18-27(29)30-2/h4-6,9-14,17,19H,3,7-8,15-16,18H2,1-2H3