N-[[1-(2-hydroxyethylsulfamoyl)-4-phenyl-azepan-4-yl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[1-(2-hydroxyethylsulfamoyl)-4-phenyl-azepan-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[1-(2-hydroxyethylsulfamoyl)-4-phenyl-azepan-4-yl]methyl]-2-methoxy-benzamide CAS Name: N-[[1-(2-hydroxyethylsulfamoyl)-4-phenyl-4-azepanyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[1-(2-hydroxyethylsulfamoyl)-4-phenylazepan-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[1-(2-hydroxyethylsulfamoyl)-4-phenyl-azepan-4-yl]methyl]-2-methoxy-benzamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCCN(CC2)S(=O)(=O)NCCO)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCCN(CC2)S(=O)(=O)NCCO)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O5S/c1-31-21-11-6-5-10-20(21)22(28)24-18-23(19-8-3-2-4-9-19)12-7-15-26(16-13-23)32(29,30)25-14-17-27/h2-6,8-11,25,27H,7,12-18H2,1H3,(H,24,28)