methyl 2-(4-tert-butylphenoxy)-2-[4-(4-chlorophenyl)sulfanylphenyl]ethanoate

Systemtic Name: methyl 2-(4-tert-butylphenoxy)-2-[4-(4-chlorophenyl)sulfanylphenyl]ethanoate Openeye Name: methyl 2-(4-tert-butylphenoxy)-2-[4-(4-chlorophenyl)sulfanylphenyl]acetate CAS Name: 2-(4-tert-butylphenoxy)-2-[4-[(4-chlorophenyl)thio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenoxy)-2-[4-(4-chlorophenyl)sulfanylphenyl]acetate Traditional Name: 2-(4-tert-butylphenoxy)-2-[4-[(4-chlorophenyl)thio]phenyl]acetic acid methyl ester Formula: C25H25ClO3S MolecularWeight: 440.9822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(C2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(C2=CC=C(C=C2)SC3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C25H25ClO3S/c1-25(2,3)18-7-11-20(12-8-18)29-23(24(27)28-4)17-5-13-21(14-6-17)30-22-15-9-19(26)10-16-22/h5-16,23H,1-4H3