2-ethyl-4-[(E)-hex-1-enyl]-5-methylsulfonyl-benzoyl chloride

Systemtic Name: 2-ethyl-4-[(E)-hex-1-enyl]-5-methylsulfonyl-benzoyl chloride Openeye Name: 2-ethyl-4-[(E)-hex-1-enyl]-5-methylsulfonyl-benzoyl chloride CAS Name: 2-ethyl-4-[(E)-hex-1-enyl]-5-methylsulfonylbenzoyl chloride IUPAC Name: 2-ethyl-4-[(E)-hex-1-enyl]-5-methylsulfonylbenzoyl chloride Traditional Name: 2-ethyl-4-[(E)-hex-1-enyl]-5-mesyl-benzoyl chloride Formula: C16H21ClO3S MolecularWeight: 328.85414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1=CC(=C(C=C1S(=O)(=O)C)C(=O)Cl)CC

Isomeric SMILES

CCCC/C=C/C1=CC(=C(C=C1S(=O)(=O)C)C(=O)Cl)CC

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/h8-11H,4-7H2,1-3H3/b9-8+