2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2-furylmethyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(2-furanylmethyl)acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(2-furfuryl)acetamide Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)NCC3=CC=CO3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)NCC3=CC=CO3)OC1

InChI

InChI=1S/C16H17NO4S/c18-16(17-10-12-3-1-6-19-12)11-22-13-4-5-14-15(9-13)21-8-2-7-20-14/h1,3-6,9H,2,7-8,10-11H2,(H,17,18)