5-bromanyl-4-nitro-N,2-bis(phenylmethyl)pyrazol-3-amine

Systemtic Name: 5-bromanyl-4-nitro-N,2-bis(phenylmethyl)pyrazol-3-amine Openeye Name: N,2-dibenzyl-5-bromo-4-nitro-pyrazol-3-amine CAS Name: 5-bromo-4-nitro-N,2-bis(phenylmethyl)-3-pyrazolamine IUPAC Name: N,2-dibenzyl-5-bromo-4-nitropyrazol-3-amine Traditional Name: benzyl-(2-benzyl-5-bromo-4-nitro-pyrazol-3-yl)amine Formula: C17H15BrN4O2 MolecularWeight: 387.2306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NN2CC3=CC=CC=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NN2CC3=CC=CC=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H15BrN4O2/c18-16-15(22(23)24)17(19-11-13-7-3-1-4-8-13)21(20-16)12-14-9-5-2-6-10-14/h1-10,19H,11-12H2