2-azanylidene-2-(4-methoxyphenyl)ethanenitrile; 1,2-oxathiirane 2,2-dioxide

Systemtic Name: 2-azanylidene-2-(4-methoxyphenyl)ethanenitrile; 1,2-oxathiirane 2,2-dioxide Openeye Name: 4-methoxybenzimidoyl cyanide; oxathiirane 2,2-dioxide CAS Name: 2-imino-2-(4-methoxyphenyl)acetonitrile; oxathiirane 2,2-dioxide IUPAC Name: 4-methoxybenzenecarboximidoyl cyanide; oxathiirane 2,2-dioxide Traditional Name: 2-imino-2-(4-methoxyphenyl)acetonitrile; oxathiirane 2,2-dioxide Formula: C10H10N2O4S MolecularWeight: 254.2624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=N)C#N.C1OS1(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=N)C#N.C1OS1(=O)=O

InChI

InChI=1S/C9H8N2O.CH2O3S/c1-12-8-4-2-7(3-5-8)9(11)6-10;2-5(3)1-4-5/h2-5,11H,1H3;1H2