methyl 3-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyloxybenzoate

Systemtic Name: methyl 3-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyloxybenzoate Openeye Name: methyl 3-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]oxybenzoate CAS Name: 3-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]oxybenzoate Traditional Name: 3-[4-[[(4-chlorophenyl)thio]methyl]benzoyl]oxybenzoic acid methyl ester Formula: C22H17ClO4S MolecularWeight: 412.88598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H17ClO4S/c1-26-21(24)17-3-2-4-19(13-17)27-22(25)16-7-5-15(6-8-16)14-28-20-11-9-18(23)10-12-20/h2-13H,14H2,1H3