2-(benzotriazol-1-ylmethylamino)-4-nitro-phenol

Systemtic Name: 2-(benzotriazol-1-ylmethylamino)-4-nitro-phenol Openeye Name: 2-(benzotriazol-1-ylmethylamino)-4-nitro-phenol CAS Name: 2-(1-benzotriazolylmethylamino)-4-nitrophenol IUPAC Name: 2-(benzotriazol-1-ylmethylamino)-4-nitrophenol Traditional Name: 2-(benzotriazol-1-ylmethylamino)-4-nitro-phenol Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C13H11N5O3/c19-13-6-5-9(18(20)21)7-11(13)14-8-17-12-4-2-1-3-10(12)15-16-17/h1-7,14,19H,8H2