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

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-5-nitro-6-piperidin-1-yl-pyrimidine Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-5-nitro-6-(1-piperidyl)pyrimidine CAS Name: 4-(4-chloro-3-methylphenoxy)-5-nitro-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-(4-chloro-3-methylphenoxy)-5-nitro-6-piperidin-1-ylpyrimidine Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-5-nitro-6-piperidino-pyrimidine Formula: C16H17ClN4O3 MolecularWeight: 348.78418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3)Cl

InChI

InChI=1S/C16H17ClN4O3/c1-11-9-12(5-6-13(11)17)24-16-14(21(22)23)15(18-10-19-16)20-7-3-2-4-8-20/h5-6,9-10H,2-4,7-8H2,1H3