6-(4-bromanylphenoxy)-N-(diphenylmethyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-bromanylphenoxy)-N-(diphenylmethyl)-5-nitro-pyrimidin-4-amine Openeye Name: N-benzhydryl-6-(4-bromophenoxy)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-bromophenoxy)-N-(diphenylmethyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-benzhydryl-6-(4-bromophenoxy)-5-nitropyrimidin-4-amine Traditional Name: benzhydryl-[6-(4-bromophenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C23H17BrN4O3 MolecularWeight: 477.31008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=C(C(=NC=N3)OC4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=C(C(=NC=N3)OC4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H17BrN4O3/c24-18-11-13-19(14-12-18)31-23-21(28(29)30)22(25-15-26-23)27-20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-15,20H,(H,25,26,27)