4-[(pentanoylamino)methyl]benzenesulfonyl chloride

Systemtic Name: 4-[(pentanoylamino)methyl]benzenesulfonyl chloride Openeye Name: 4-[(pentanoylamino)methyl]benzenesulfonyl chloride CAS Name: 4-[(1-oxopentylamino)methyl]benzenesulfonyl chloride IUPAC Name: 4-[(pentanoylamino)methyl]benzenesulfonyl chloride Traditional Name: 4-[(valerylamino)methyl]benzenesulfonyl chloride Formula: C12H16ClNO3S MolecularWeight: 289.77834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO3S/c1-2-3-4-12(15)14-9-10-5-7-11(8-6-10)18(13,16)17/h5-8H,2-4,9H2,1H3,(H,14,15)