N6-hexadecyl-5-nitro-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine

Systemtic Name: N6-hexadecyl-5-nitro-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Openeye Name: N6-hexadecyl-5-nitro-N4-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidine-4,6-diamine CAS Name: N6-hexadecyl-5-nitro-N4-(2,2,6,6-tetramethyl-4-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-hexadecyl-5-nitro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Traditional Name: cetyl-[5-nitro-6-[(2,2,6,6-tetramethyl-4-piperidyl)amino]pyrimidin-4-yl]amine Formula: C29H54N6O2 MolecularWeight: 518.77806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2CC(NC(C2)(C)C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2CC(NC(C2)(C)C)(C)C

InChI

InChI=1S/C29H54N6O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-26-25(35(36)37)27(32-23-31-26)33-24-21-28(2,3)34-29(4,5)22-24/h23-24,34H,6-22H2,1-5H3,(H2,30,31,32,33)