2-ethyl-4-[(E)-hex-3-enyl]-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 2-ethyl-4-[(E)-hex-3-enyl]-5-methylsulfonyl-benzoyl chloride Openeye Name: 2-ethyl-4-[(E)-hex-3-enyl]-5-methylsulfonyl-benzoyl chloride CAS Name: 2-ethyl-4-[(E)-hex-3-enyl]-5-methylsulfonylbenzoyl chloride IUPAC Name: 2-ethyl-4-[(E)-hex-3-enyl]-5-methylsulfonylbenzoyl chloride Traditional Name: 2-ethyl-4-[(E)-hex-3-enyl]-5-mesyl-benzoyl chloride Formula: C16H21ClO3S MolecularWeight: 328.85414

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCC1=C(C=C(C(=C1)CC)C(=O)Cl)S(=O)(=O)C

Isomeric SMILES

CC/C=C/CCC1=C(C=C(C(=C1)CC)C(=O)Cl)S(=O)(=O)C

InChI

InChI=1S/C16H21ClO3S/c1-4-6-7-8-9-13-10-12(5-2)14(16(17)18)11-15(13)21(3,19)20/h6-7,10-11H,4-5,8-9H2,1-3H3/b7-6+