N-[(4-dimethylaminophenyl)methyl]azepane-1-sulfonamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]azepane-1-sulfonamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]azepane-1-sulfonamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-1-azepanesulfonamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]azepane-1-sulfonamide Traditional Name: N-[4-(dimethylamino)benzyl]azepane-1-sulfonamide Formula: C15H25N3O2S MolecularWeight: 311.4429

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNS(=O)(=O)N2CCCCCC2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNS(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C15H25N3O2S/c1-17(2)15-9-7-14(8-10-15)13-16-21(19,20)18-11-5-3-4-6-12-18/h7-10,16H,3-6,11-13H2,1-2H3