2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(3-morpholinosulfonylphenyl)acetamide CAS Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(3-morpholinosulfonylphenyl)acetamide Formula: C21H23ClN2O6S MolecularWeight: 466.93512

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)Cl)OC1

InChI

InChI=1S/C21H23ClN2O6S/c22-18-11-15(12-19-21(18)30-8-2-7-29-19)13-20(25)23-16-3-1-4-17(14-16)31(26,27)24-5-9-28-10-6-24/h1,3-4,11-12,14H,2,5-10,13H2,(H,23,25)