4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-6-piperidin-1-yl-pyrimidine Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-6-(1-piperidyl)pyrimidine CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitro-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-5-nitro-6-piperidin-1-ylpyrimidine Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-6-piperidino-pyrimidine Formula: C17H19ClN4O3 MolecularWeight: 362.81076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C17H19ClN4O3/c1-11-8-13(9-12(2)14(11)18)25-17-15(22(23)24)16(19-10-20-17)21-6-4-3-5-7-21/h8-10H,3-7H2,1-2H3