4-(2-ethylpiperidin-1-yl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine

Systemtic Name: 4-(2-ethylpiperidin-1-yl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Openeye Name: 4-(2-ethyl-1-piperidyl)-6-(4-isopropylphenoxy)-5-nitro-pyrimidine CAS Name: 4-(2-ethyl-1-piperidinyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine IUPAC Name: 4-(2-ethylpiperidin-1-yl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Traditional Name: 4-(2-ethylpiperidino)-6-(4-isopropylphenoxy)-5-nitro-pyrimidine Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O3/c1-4-16-7-5-6-12-23(16)19-18(24(25)26)20(22-13-21-19)27-17-10-8-15(9-11-17)14(2)3/h8-11,13-14,16H,4-7,12H2,1-3H3