N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-methylsulfonyl-benzamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-methylsulfonyl-benzamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-methylsulfonyl-benzamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-methylsulfonylbenzamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-methylsulfonylbenzamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-mesyl-benzamide Formula: C17H16ClNO5S MolecularWeight: 381.83064

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

InChI

InChI=1S/C17H16ClNO5S/c1-25(21,22)12-5-2-4-11(8-12)17(20)19-14-10-16-15(9-13(14)18)23-6-3-7-24-16/h2,4-5,8-10H,3,6-7H2,1H3,(H,19,20)