5-[(butanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride

Systemtic Name: 5-[(butanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride Openeye Name: 5-[(butanoylamino)methyl]-2-methoxy-benzenesulfonyl chloride CAS Name: 2-methoxy-5-[(1-oxobutylamino)methyl]benzenesulfonyl chloride IUPAC Name: 5-[(butanoylamino)methyl]-2-methoxybenzenesulfonyl chloride Traditional Name: 5-(butyramidomethyl)-2-methoxy-benzenesulfonyl chloride Formula: C12H16ClNO4S MolecularWeight: 305.77774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCC1=CC(=C(C=C1)OC)S(=O)(=O)Cl

Isomeric SMILES

CCCC(=O)NCC1=CC(=C(C=C1)OC)S(=O)(=O)Cl

InChI

InChI=1S/C12H16ClNO4S/c1-3-4-12(15)14-8-9-5-6-10(18-2)11(7-9)19(13,16)17/h5-7H,3-4,8H2,1-2H3,(H,14,15)