N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C19H22N2O5S MolecularWeight: 390.45338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)N(C)C(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)N)N(C)C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H22N2O5S/c1-13(14-4-7-16(8-5-14)27(20,23)24)21(2)19(22)15-6-9-17-18(12-15)26-11-3-10-25-17/h4-9,12-13H,3,10-11H2,1-2H3,(H2,20,23,24)