4-[2-(4-methoxyphenyl)azepan-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[2-(4-methoxyphenyl)azepan-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[2-(4-methoxyphenyl)azepan-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[2-(4-methoxyphenyl)-1-azepanyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[2-(4-methoxyphenyl)azepan-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[2-(4-methoxyphenyl)azepan-1-yl]sulfonylbenzenesulfonamide Formula: C19H24N2O5S2 MolecularWeight: 424.53426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H24N2O5S2/c1-26-16-8-6-15(7-9-16)19-5-3-2-4-14-21(19)28(24,25)18-12-10-17(11-13-18)27(20,22)23/h6-13,19H,2-5,14H2,1H3,(H2,20,22,23)