2-[(4-propan-2-ylphenyl)methylsulfanyl]benzoate

Systemtic Name: 2-[(4-propan-2-ylphenyl)methylsulfanyl]benzoate Openeye Name: 2-[(4-isopropylphenyl)methylsulfanyl]benzoate CAS Name: 2-[(4-propan-2-ylphenyl)methylthio]benzoate IUPAC Name: 2-[(4-propan-2-ylphenyl)methylsulfanyl]benzoate Traditional Name: 2-[(4-isopropylbenzyl)thio]benzoate Formula: C17H17O2S- MolecularWeight: 285.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C17H18O2S/c1-12(2)14-9-7-13(8-10-14)11-20-16-6-4-3-5-15(16)17(18)19/h3-10,12H,11H2,1-2H3,(H,18,19)/p-1