3-(azepan-1-ylcarbonyl)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-4-methoxy-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-4-methoxy-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-4-methoxybenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-4-methoxybenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-[4-(4-fluorobenzyl)oxybenzyl]-4-methoxy-benzenesulfonamide Formula: C28H31FN2O5S MolecularWeight: 526.619543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C(=O)N4CCCCCC4

InChI

InChI=1S/C28H31FN2O5S/c1-35-27-15-14-25(18-26(27)28(32)31-16-4-2-3-5-17-31)37(33,34)30-19-21-8-12-24(13-9-21)36-20-22-6-10-23(29)11-7-22/h6-15,18,30H,2-5,16-17,19-20H2,1H3