3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)azepan-2-one

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)azepan-2-one Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)azepan-2-one CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-2-azepanone IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)azepan-2-one Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)azepan-2-one Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H19NO3S/c17-15-14(4-1-2-7-16-15)20-11-5-6-12-13(10-11)19-9-3-8-18-12/h5-6,10,14H,1-4,7-9H2,(H,16,17)