N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]azepane-1-sulfonamide

Systemtic Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]azepane-1-sulfonamide Openeye Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]azepane-1-sulfonamide CAS Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-1-azepanesulfonamide IUPAC Name: N-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]azepane-1-sulfonamide Traditional Name: N-[1-(4-mesylphenyl)ethyl]-N-methyl-azepane-1-sulfonamide Formula: C16H26N2O4S2 MolecularWeight: 374.51864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C16H26N2O4S2/c1-14(15-8-10-16(11-9-15)23(3,19)20)17(2)24(21,22)18-12-6-4-5-7-13-18/h8-11,14H,4-7,12-13H2,1-3H3