N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(3-methyl-1,1-dioxo-thiolan-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(3-methyl-1,1-dioxothiolan-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H19NO5S/c1-15(5-8-22(18,19)10-15)16-14(17)11-3-4-12-13(9-11)21-7-2-6-20-12/h3-4,9H,2,5-8,10H2,1H3,(H,16,17)