5-nitro-N-(phenylmethyl)-6-pyridin-3-yloxy-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(phenylmethyl)-6-pyridin-3-yloxy-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-6-(3-pyridyloxy)pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-6-(3-pyridinyloxy)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-6-pyridin-3-yloxypyrimidin-4-amine Traditional Name: benzyl-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]amine Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O3/c22-21(23)14-15(18-9-12-5-2-1-3-6-12)19-11-20-16(14)24-13-7-4-8-17-10-13/h1-8,10-11H,9H2,(H,18,19,20)