4-(azepan-1-ylcarbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(4-ethoxyphenyl)benzenesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)benzenesulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-p-phenetyl-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O4S/c1-2-27-19-11-9-18(10-12-19)22-28(25,26)20-13-7-17(8-14-20)21(24)23-15-5-3-4-6-16-23/h7-14,22H,2-6,15-16H2,1H3