4-(4-chloranyl-3-methyl-phenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidine

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidine Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidine CAS Name: 4-(4-chloro-3-methylphenoxy)-6-(2-ethyl-1-piperidinyl)-5-nitropyrimidine IUPAC Name: 4-(4-chloro-3-methylphenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitropyrimidine Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-6-(2-ethylpiperidino)-5-nitro-pyrimidine Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O3/c1-3-13-6-4-5-9-22(13)17-16(23(24)25)18(21-11-20-17)26-14-7-8-15(19)12(2)10-14/h7-8,10-11,13H,3-6,9H2,1-2H3