4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide

Systemtic Name: 4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide Openeye Name: 4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide CAS Name: 4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide IUPAC Name: 4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide Traditional Name: 4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=C(C=C3)C(=O)N)C4CC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N(CC3=CC=C(C=C3)C(=O)N)C4CC4)OC1

InChI

InChI=1S/C20H22N2O5S/c21-20(23)15-4-2-14(3-5-15)13-22(16-6-7-16)28(24,25)17-8-9-18-19(12-17)27-11-1-10-26-18/h2-5,8-9,12,16H,1,6-7,10-11,13H2,(H2,21,23)