2,6-bis(bromanyl)-4-nitro-aniline; 2-(phenylmethyl)pyrazol-3-amine

Systemtic Name: 2,6-bis(bromanyl)-4-nitro-aniline; 2-(phenylmethyl)pyrazol-3-amine Openeye Name: 2-benzylpyrazol-3-amine; 2,6-dibromo-4-nitro-aniline CAS Name: 2,6-dibromo-4-nitroaniline; 2-(phenylmethyl)-3-pyrazolamine IUPAC Name: 2-benzylpyrazol-3-amine; 2,6-dibromo-4-nitroaniline Traditional Name: (2-benzylpyrazol-3-yl)amine; (2,6-dibromo-4-nitro-phenyl)amine Formula: C16H15Br2N5O2 MolecularWeight: 469.1306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)N.C1=C(C=C(C(=C1Br)N)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)N.C1=C(C=C(C(=C1Br)N)Br)[N+](=O)[O-]

InChI

InChI=1S/C10H11N3.C6H4Br2N2O2/c11-10-6-7-12-13(10)8-9-4-2-1-3-5-9;7-4-1-3(10(11)12)2-5(8)6(4)9/h1-7H,8,11H2;1-2H,9H2