5-(1,3-dithian-2-yl)-2-nitro-benzenecarbonitrile

Systemtic Name: 5-(1,3-dithian-2-yl)-2-nitro-benzenecarbonitrile Openeye Name: 5-(1,3-dithian-2-yl)-2-nitro-benzonitrile CAS Name: 5-(1,3-dithian-2-yl)-2-nitrobenzonitrile IUPAC Name: 5-(1,3-dithian-2-yl)-2-nitrobenzonitrile Traditional Name: 5-(1,3-dithian-2-yl)-2-nitro-benzonitrile Formula: C11H10N2O2S2 MolecularWeight: 266.3393

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1CSC(SC1)C2=CC(=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C11H10N2O2S2/c12-7-9-6-8(2-3-10(9)13(14)15)11-16-4-1-5-17-11/h2-3,6,11H,1,4-5H2