4-nitro-1-propan-2-yl-benzotriazole

Systemtic Name: 4-nitro-1-propan-2-yl-benzotriazole Openeye Name: 1-isopropyl-4-nitro-benzotriazole CAS Name: 4-nitro-1-propan-2-ylbenzotriazole IUPAC Name: 4-nitro-1-propan-2-ylbenzotriazole Traditional Name: 1-isopropyl-4-nitro-benzotriazole Formula: C9H10N4O2 MolecularWeight: 206.2013

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=CC=C2)[N+](=O)[O-])N=N1

Isomeric SMILES

CC(C)N1C2=C(C(=CC=C2)[N+](=O)[O-])N=N1

InChI

InChI=1S/C9H10N4O2/c1-6(2)12-7-4-3-5-8(13(14)15)9(7)10-11-12/h3-6H,1-2H3