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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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