6-(4-bromanylphenoxy)-N-[(4-chlorophenyl)methyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-bromanylphenoxy)-N-[(4-chlorophenyl)methyl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-bromophenoxy)-N-[(4-chlorophenyl)methyl]-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-bromophenoxy)-N-[(4-chlorophenyl)methyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-bromophenoxy)-N-[(4-chlorophenyl)methyl]-5-nitropyrimidin-4-amine Traditional Name: [6-(4-bromophenoxy)-5-nitro-pyrimidin-4-yl]-(4-chlorobenzyl)amine Formula: C17H12BrClN4O3 MolecularWeight: 435.65918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C(=NC=N2)OC3=CC=C(C=C3)Br)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12BrClN4O3/c18-12-3-7-14(8-4-12)26-17-15(23(24)25)16(21-10-22-17)20-9-11-1-5-13(19)6-2-11/h1-8,10H,9H2,(H,20,21,22)