6-chloranyl-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C21H25ClN2O6S MolecularWeight: 468.951

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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)Cl)OCCCO3

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O6S/c1-4-24(5-2)31(26,27)15-7-8-18(28-3)17(13-15)23-21(25)14-11-16(22)20-19(12-14)29-9-6-10-30-20/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,23,25)