6-chloranyl-N-(1-methylsulfonylpiperidin-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-(1-methylsulfonylpiperidin-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-(1-methylsulfonyl-4-piperidyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-(1-methylsulfonyl-4-piperidinyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-(1-methylsulfonylpiperidin-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-(1-mesyl-4-piperidyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C16H21ClN2O5S MolecularWeight: 388.86634

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C16H21ClN2O5S/c1-25(21,22)19-5-3-12(4-6-19)18-16(20)11-9-13(17)15-14(10-11)23-7-2-8-24-15/h9-10,12H,2-8H2,1H3,(H,18,20)