4-[3-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]propoxy]benzenecarbonitrile Openeye Name: 4-[3-[(1,1-dioxothiolan-3-yl)-methyl-amino]propoxy]benzonitrile CAS Name: 4-[3-[(1,1-dioxo-3-thiolanyl)-methylamino]propoxy]benzonitrile IUPAC Name: 4-[3-[(1,1-dioxothiolan-3-yl)-methylamino]propoxy]benzonitrile Traditional Name: 4-[3-[(1,1-diketothiolan-3-yl)-methyl-amino]propoxy]benzonitrile Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=CC=C(C=C1)C#N)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CCCOC1=CC=C(C=C1)C#N)C2CCS(=O)(=O)C2

InChI

InChI=1S/C15H20N2O3S/c1-17(14-7-10-21(18,19)12-14)8-2-9-20-15-5-3-13(11-16)4-6-15/h3-6,14H,2,7-10,12H2,1H3