5-nitro-1-prop-2-enyl-benzotriazole

Systemtic Name: 5-nitro-1-prop-2-enyl-benzotriazole Openeye Name: 1-allyl-5-nitro-benzotriazole CAS Name: 5-nitro-1-prop-2-enylbenzotriazole IUPAC Name: 5-nitro-1-prop-2-enylbenzotriazole Traditional Name: 1-allyl-5-nitro-benzotriazole Formula: C9H8N4O2 MolecularWeight: 204.18542

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=N1

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=N1

InChI

InChI=1S/C9H8N4O2/c1-2-5-12-9-4-3-7(13(14)15)6-8(9)10-11-12/h2-4,6H,1,5H2