N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]-4-methoxy-benzamide CAS Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]-4-methoxybenzamide Traditional Name: N-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]-4-methoxy-benzamide Formula: C19H19NO5S MolecularWeight: 373.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H19NO5S/c1-23-14-5-3-13(4-6-14)19(22)20-18(21)12-26-15-7-8-16-17(11-15)25-10-2-9-24-16/h3-8,11H,2,9-10,12H2,1H3,(H,20,21,22)