N-methyl-4-[2-(phenylsulfonyl)phenoxy]butan-1-amine chloride

Systemtic Name: N-methyl-4-[2-(phenylsulfonyl)phenoxy]butan-1-amine chloride Openeye Name: 4-[2-(benzenesulfonyl)phenoxy]-N-methyl-butan-1-amine chloride CAS Name: 4-[2-(benzenesulfonyl)phenoxy]-N-methyl-1-butanamine chloride IUPAC Name: 4-[2-(benzenesulfonyl)phenoxy]-N-methylbutan-1-amine chloride Traditional Name: 4-(2-besylphenoxy)butyl-methyl-amine chloride Formula: C17H21ClNO3S- MolecularWeight: 354.87154

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCOC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CNCCCCOC1=CC=CC=C1S(=O)(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C17H21NO3S.ClH/c1-18-13-7-8-14-21-16-11-5-6-12-17(16)22(19,20)15-9-3-2-4-10-15;/h2-6,9-12,18H,7-8,13-14H2,1H3;1H/p-1