5-nitro-N4-(4-phenylmethoxyphenyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(4-phenylmethoxyphenyl)pyrimidine-4,6-diamine Openeye Name: N4-(4-benzyloxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(4-phenylmethoxyphenyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(4-phenylmethoxyphenyl)pyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-(4-benzoxyphenyl)amine Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC3=NC=NC(=C3[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC3=NC=NC(=C3[N+](=O)[O-])N

InChI

InChI=1S/C17H15N5O3/c18-16-15(22(23)24)17(20-11-19-16)21-13-6-8-14(9-7-13)25-10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H3,18,19,20,21)