N-(4-butylphenyl)-6-ethoxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(4-butylphenyl)-6-ethoxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(4-butylphenyl)-6-ethoxy-5-nitro-pyrimidin-4-amine CAS Name: N-(4-butylphenyl)-6-ethoxy-5-nitro-4-pyrimidinamine IUPAC Name: N-(4-butylphenyl)-6-ethoxy-5-nitropyrimidin-4-amine Traditional Name: (4-butylphenyl)-(6-ethoxy-5-nitro-pyrimidin-4-yl)amine Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3/c1-3-5-6-12-7-9-13(10-8-12)19-15-14(20(21)22)16(23-4-2)18-11-17-15/h7-11H,3-6H2,1-2H3,(H,17,18,19)