7-nitro-1,2-benzothiazole-5-carbonitrile

Systemtic Name: 7-nitro-1,2-benzothiazole-5-carbonitrile Openeye Name: 7-nitro-1,2-benzothiazole-5-carbonitrile CAS Name: 7-nitro-1,2-benzothiazole-5-carbonitrile IUPAC Name: 7-nitro-1,2-benzothiazole-5-carbonitrile Traditional Name: 7-nitro-1,2-benzothiazole-5-carbonitrile Formula: C8H3N3O2S MolecularWeight: 205.19332

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1C=NS2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=C(C=C(C2=C1C=NS2)[N+](=O)[O-])C#N

InChI

InChI=1S/C8H3N3O2S/c9-3-5-1-6-4-10-14-8(6)7(2-5)11(12)13/h1-2,4H