N-(4-butylphenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(4-butylphenyl)-6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(4-butylphenyl)-6-(2-naphthyloxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(4-butylphenyl)-6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(4-butylphenyl)-6-naphthalen-2-yloxy-5-nitropyrimidin-4-amine Traditional Name: (4-butylphenyl)-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C24H22N4O3 MolecularWeight: 414.45648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O3/c1-2-3-6-17-9-12-20(13-10-17)27-23-22(28(29)30)24(26-16-25-23)31-21-14-11-18-7-4-5-8-19(18)15-21/h4-5,7-16H,2-3,6H2,1H3,(H,25,26,27)