ethyl 3-(4-chlorophenyl)-2-methyl-2-[4-(thian-4-yl)phenoxy]propanoate

Systemtic Name: ethyl 3-(4-chlorophenyl)-2-methyl-2-[4-(thian-4-yl)phenoxy]propanoate Openeye Name: ethyl 3-(4-chlorophenyl)-2-methyl-2-(4-tetrahydrothiopyran-4-ylphenoxy)propanoate CAS Name: 3-(4-chlorophenyl)-2-methyl-2-[4-(4-thianyl)phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-2-methyl-2-[4-(thian-4-yl)phenoxy]propanoate Traditional Name: 3-(4-chlorophenyl)-2-methyl-2-(4-tetrahydrothiopyran-4-ylphenoxy)propionic acid ethyl ester Formula: C23H27ClO3S MolecularWeight: 418.97668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)C3CCSCC3

Isomeric SMILES

CCOC(=O)C(C)(CC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)C3CCSCC3

InChI

InChI=1S/C23H27ClO3S/c1-3-26-22(25)23(2,16-17-4-8-20(24)9-5-17)27-21-10-6-18(7-11-21)19-12-14-28-15-13-19/h4-11,19H,3,12-16H2,1-2H3