4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(1,1-dioxothiolan-3-yl)-methyl-amino]ethoxy]benzonitrile CAS Name: 4-[2-[(1,1-dioxo-3-thiolanyl)-methylamino]ethoxy]benzonitrile IUPAC Name: 4-[2-[(1,1-dioxothiolan-3-yl)-methylamino]ethoxy]benzonitrile Traditional Name: 4-[2-[(1,1-diketothiolan-3-yl)-methyl-amino]ethoxy]benzonitrile Formula: C14H18N2O3S MolecularWeight: 294.36932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)C#N)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)C#N)C2CCS(=O)(=O)C2

InChI

InChI=1S/C14H18N2O3S/c1-16(13-6-9-20(17,18)11-13)7-8-19-14-4-2-12(10-15)3-5-14/h2-5,13H,6-9,11H2,1H3