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

Systemtic Name: ethyl 2-chloranyl-2-[3-[3-(4-cyclohexyl-2-propyl-phenoxy)propoxy]phenyl]ethanoate Openeye Name: ethyl 2-chloro-2-[3-[3-(4-cyclohexyl-2-propyl-phenoxy)propoxy]phenyl]acetate CAS Name: 2-chloro-2-[3-[3-(4-cyclohexyl-2-propylphenoxy)propoxy]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-chloro-2-[3-[3-(4-cyclohexyl-2-propylphenoxy)propoxy]phenyl]acetate Traditional Name: 2-chloro-2-[3-[3-(4-cyclohexyl-2-propyl-phenoxy)propoxy]phenyl]acetic acid ethyl ester Formula: C28H37ClO4 MolecularWeight: 473.04398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2CCCCC2)OCCCOC3=CC=CC(=C3)C(C(=O)OCC)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2CCCCC2)OCCCOC3=CC=CC(=C3)C(C(=O)OCC)Cl

InChI

InChI=1S/C28H37ClO4/c1-3-10-23-19-22(21-11-6-5-7-12-21)15-16-26(23)33-18-9-17-32-25-14-8-13-24(20-25)27(29)28(30)31-4-2/h8,13-16,19-21,27H,3-7,9-12,17-18H2,1-2H3