4-[(hexanoylamino)methyl]benzenesulfonyl chloride

Systemtic Name: 4-[(hexanoylamino)methyl]benzenesulfonyl chloride Openeye Name: 4-[(hexanoylamino)methyl]benzenesulfonyl chloride CAS Name: 4-[(1-oxohexylamino)methyl]benzenesulfonyl chloride IUPAC Name: 4-[(hexanoylamino)methyl]benzenesulfonyl chloride Traditional Name: 4-[(caproylamino)methyl]benzenesulfonyl chloride Formula: C13H18ClNO3S MolecularWeight: 303.80492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)Cl

Isomeric SMILES

CCCCCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)Cl

InChI

InChI=1S/C13H18ClNO3S/c1-2-3-4-5-13(16)15-10-11-6-8-12(9-7-11)19(14,17)18/h6-9H,2-5,10H2,1H3,(H,15,16)