2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide Traditional Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(5-mesyl-2-methyl-phenyl)acetamide Formula: C19H20ClNO5S MolecularWeight: 409.8838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CC2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C19H20ClNO5S/c1-12-4-5-14(27(2,23)24)11-16(12)21-18(22)10-13-8-15(20)19-17(9-13)25-6-3-7-26-19/h4-5,8-9,11H,3,6-7,10H2,1-2H3,(H,21,22)