3-(azepan-1-ylcarbonyl)-4-methoxy-benzenesulfonyl chloride

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-benzenesulfonyl chloride Openeye Name: 3-(azepane-1-carbonyl)-4-methoxy-benzenesulfonyl chloride CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxybenzenesulfonyl chloride IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxybenzenesulfonyl chloride Traditional Name: 3-(azepane-1-carbonyl)-4-methoxy-benzenesulfonyl chloride Formula: C14H18ClNO4S MolecularWeight: 331.81502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)Cl)C(=O)N2CCCCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)Cl)C(=O)N2CCCCCC2

InChI

InChI=1S/C14H18ClNO4S/c1-20-13-7-6-11(21(15,18)19)10-12(13)14(17)16-8-4-2-3-5-9-16/h6-7,10H,2-5,8-9H2,1H3