3-[3-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]propoxy]benzenecarbonitrile Openeye Name: 3-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)propoxy]benzonitrile CAS Name: 3-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)propoxy]benzonitrile IUPAC Name: 3-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)propoxy]benzonitrile Traditional Name: 3-[3-(1,1-diketo-1,2-thiazolidin-2-yl)propoxy]benzonitrile Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(S(=O)(=O)C1)CCCOC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(S(=O)(=O)C1)CCCOC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H16N2O3S/c14-11-12-4-1-5-13(10-12)18-8-2-6-15-7-3-9-19(15,16)17/h1,4-5,10H,2-3,6-9H2