6-(4-ethylphenoxy)-5-nitro-N,N-bis(phenylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(4-ethylphenoxy)-5-nitro-N,N-bis(phenylmethyl)pyrimidin-4-amine Openeye Name: N,N-dibenzyl-6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-ethylphenoxy)-5-nitro-N,N-bis(phenylmethyl)-4-pyrimidinamine IUPAC Name: N,N-dibenzyl-6-(4-ethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: dibenzyl-[6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O3/c1-2-20-13-15-23(16-14-20)33-26-24(30(31)32)25(27-19-28-26)29(17-21-9-5-3-6-10-21)18-22-11-7-4-8-12-22/h3-16,19H,2,17-18H2,1H3