N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanamide Openeye Name: N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide CAS Name: N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide IUPAC Name: N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide Traditional Name: N-(1-adamantyl)-2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetamide Formula: C22H30N2O5S MolecularWeight: 434.549

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CN(CC(=O)NC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C22H30N2O5S/c1-24(30(26,27)18-3-4-19-20(10-18)29-6-2-5-28-19)14-21(25)23-22-11-15-7-16(12-22)9-17(8-15)13-22/h3-4,10,15-17H,2,5-9,11-14H2,1H3,(H,23,25)