N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(N-mesyl-2-methyl-anilino)acetamide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O5S/c1-14-6-3-4-7-16(14)21(27(2,23)24)13-19(22)20-15-8-9-17-18(12-15)26-11-5-10-25-17/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,20,22)