2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-ethyl-6-methyl-phenyl)propanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-ethyl-6-methyl-phenyl)propanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-ethyl-6-methyl-phenyl)propanamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-ethyl-6-methylphenyl)propanamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-(2-ethyl-6-methylphenyl)propanamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]-N-(2-ethyl-6-methyl-phenyl)propionamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C)N(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C)C

InChI

InChI=1S/C21H26N2O5S/c1-5-16-8-6-7-14(2)20(16)22-21(24)15(3)23(29(4,25)26)17-9-10-18-19(13-17)28-12-11-27-18/h6-10,13,15H,5,11-12H2,1-4H3,(H,22,24)