N-[(2-bromophenyl)methyl]-N-methyl-azepane-1-sulfonamide

Systemtic Name: N-[(2-bromophenyl)methyl]-N-methyl-azepane-1-sulfonamide Openeye Name: N-[(2-bromophenyl)methyl]-N-methyl-azepane-1-sulfonamide CAS Name: N-[(2-bromophenyl)methyl]-N-methyl-1-azepanesulfonamide IUPAC Name: N-[(2-bromophenyl)methyl]-N-methylazepane-1-sulfonamide Traditional Name: N-(2-bromobenzyl)-N-methyl-azepane-1-sulfonamide Formula: C14H21BrN2O2S MolecularWeight: 361.29774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CN(CC1=CC=CC=C1Br)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C14H21BrN2O2S/c1-16(12-13-8-4-5-9-14(13)15)20(18,19)17-10-6-2-3-7-11-17/h4-5,8-9H,2-3,6-7,10-12H2,1H3