N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H26N2O6S/c1-4-23(5-2)30(25,26)16-8-10-18(27-3)17(14-16)22-21(24)15-7-9-19-20(13-15)29-12-6-11-28-19/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,22,24)