5-(azepan-1-ylcarbonyl)-N-(4-ethylphenyl)-2-methoxy-benzenesulfonamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-(4-ethylphenyl)-2-methoxy-benzenesulfonamide Openeye Name: 5-(azepane-1-carbonyl)-N-(4-ethylphenyl)-2-methoxy-benzenesulfonamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-(4-ethylphenyl)-2-methoxybenzenesulfonamide IUPAC Name: 5-(azepane-1-carbonyl)-N-(4-ethylphenyl)-2-methoxybenzenesulfonamide Traditional Name: 5-(azepane-1-carbonyl)-N-(4-ethylphenyl)-2-methoxy-benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H28N2O4S/c1-3-17-8-11-19(12-9-17)23-29(26,27)21-16-18(10-13-20(21)28-2)22(25)24-14-6-4-5-7-15-24/h8-13,16,23H,3-7,14-15H2,1-2H3