1-[2-(chloromethyl)-4-nitro-phenyl]benzotriazole

Systemtic Name: 1-[2-(chloromethyl)-4-nitro-phenyl]benzotriazole Openeye Name: 1-[2-(chloromethyl)-4-nitro-phenyl]benzotriazole CAS Name: 1-[2-(chloromethyl)-4-nitrophenyl]benzotriazole IUPAC Name: 1-[2-(chloromethyl)-4-nitrophenyl]benzotriazole Traditional Name: 1-[2-(chloromethyl)-4-nitro-phenyl]benzotriazole Formula: C13H9ClN4O2 MolecularWeight: 288.68916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)[N+](=O)[O-])CCl

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)[N+](=O)[O-])CCl

InChI

InChI=1S/C13H9ClN4O2/c14-8-9-7-10(18(19)20)5-6-12(9)17-13-4-2-1-3-11(13)15-16-17/h1-7H,8H2