methyl 4-[(4-tert-butylphenyl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(4-tert-butylphenyl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(4-tert-butylphenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-tert-butylphenyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-tert-butylphenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-tert-butylphenyl)thio]methyl]benzoic acid methyl ester Formula: C19H22O2S MolecularWeight: 314.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H22O2S/c1-19(2,3)16-9-11-17(12-10-16)22-13-14-5-7-15(8-6-14)18(20)21-4/h5-12H,13H2,1-4H3