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

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(phenylmethyl)amino]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-N-isobutyl-acetamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(phenylmethyl)amino]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-N-(2-methylpropyl)acetamide Traditional Name: 2-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-N-isobutyl-acetamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)CNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H26N2O5S/c1-16(2)13-22-21(24)15-23(14-17-6-4-3-5-7-17)29(25,26)18-8-9-19-20(12-18)28-11-10-27-19/h3-9,12,16H,10-11,13-15H2,1-2H3,(H,22,24)