[1-[(E)-[azanyl(pyridin-3-yl)methylidene]amino]oxy-3-piperidin-1-yl-propan-2-yl] hexadecanoate

Systemtic Name: [1-[(E)-[azanyl(pyridin-3-yl)methylidene]amino]oxy-3-piperidin-1-yl-propan-2-yl] hexadecanoate Openeye Name: [1-[[(E)-[amino(3-pyridyl)methylene]amino]oxymethyl]-2-(1-piperidyl)ethyl] hexadecanoate CAS Name: hexadecanoic acid [1-[(E)-[amino(3-pyridinyl)methylidene]amino]oxy-3-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [1-[(E)-[amino(pyridin-3-yl)methylidene]amino]oxy-3-piperidin-1-ylpropan-2-yl] hexadecanoate Traditional Name: palmitic acid [1-[[(E)-[amino(3-pyridyl)methylene]amino]oxymethyl]-2-piperidino-ethyl] ester Formula: C30H52N4O3 MolecularWeight: 516.75888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CN1CCCCC1)CON=C(C2=CN=CC=C2)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CN1CCCCC1)CO/N=C(\C2=CN=CC=C2)/N

InChI

InChI=1S/C30H52N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-20-29(35)37-28(25-34-22-16-14-17-23-34)26-36-33-30(31)27-19-18-21-32-24-27/h18-19,21,24,28H,2-17,20,22-23,25-26H2,1H3,(H2,31,33)