N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]ethanamide Openeye Name: N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]acetamide CAS Name: N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]acetamide IUPAC Name: N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]acetamide Traditional Name: N-(1-adamantyl)-2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl(methyl)amino]acetamide Formula: C21H28N2O5S MolecularWeight: 420.52242

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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)OCCO5

Isomeric SMILES

CN(CC(=O)NC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H28N2O5S/c1-23(29(25,26)17-2-3-18-19(9-17)28-5-4-27-18)13-20(24)22-21-10-14-6-15(11-21)8-16(7-14)12-21/h2-3,9,14-16H,4-8,10-13H2,1H3,(H,22,24)