N2-methyl-N2-octadecyl-6-pyrrolidin-1-yl-pyridine-2,4-diamine

Systemtic Name: N2-methyl-N2-octadecyl-6-pyrrolidin-1-yl-pyridine-2,4-diamine Openeye Name: N2-methyl-N2-octadecyl-6-pyrrolidin-1-yl-pyridine-2,4-diamine CAS Name: N2-methyl-N2-octadecyl-6-(1-pyrrolidinyl)pyridine-2,4-diamine IUPAC Name: 2-N-methyl-2-N-octadecyl-6-pyrrolidin-1-ylpyridine-2,4-diamine Traditional Name: (4-amino-6-pyrrolidino-2-pyridyl)-methyl-stearyl-amine Formula: C28H52N4 MolecularWeight: 444.73928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)C1=CC(=CC(=N1)N2CCCC2)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)C1=CC(=CC(=N1)N2CCCC2)N

InChI

InChI=1S/C28H52N4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31(2)27-24-26(29)25-28(30-27)32-22-19-20-23-32/h24-25H,3-23H2,1-2H3,(H2,29,30)