(2-propoxyphenyl) 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: (2-propoxyphenyl) 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: (2-propoxyphenyl) 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid (2-propoxyphenyl) ester IUPAC Name: (2-propoxyphenyl) 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid (2-propoxyphenyl) ester Formula: C17H17ClO5S MolecularWeight: 368.83188

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CCCOC1=CC=CC=C1OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H17ClO5S/c1-3-10-22-15-6-4-5-7-16(15)23-17(19)13-11-12(24(2,20)21)8-9-14(13)18/h4-9,11H,3,10H2,1-2H3