2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN(C)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3)C

InChI

InChI=1S/C21H26N2O5S/c1-4-16-8-5-7-15(2)21(16)22-20(24)14-23(3)29(25,26)17-9-10-18-19(13-17)28-12-6-11-27-18/h5,7-10,13H,4,6,11-12,14H2,1-3H3,(H,22,24)