4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(3-methoxyphenoxy)ethyl]benzamide Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=CC(=CC=C1)OCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H26N2O7S/c1-31-20-4-2-5-21(16-20)32-15-12-26-25(28)18-6-8-19(9-7-18)27-35(29,30)22-10-11-23-24(17-22)34-14-3-13-33-23/h2,4-11,16-17,27H,3,12-15H2,1H3,(H,26,28)