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(2-methyl-2-nitro-3-octadecanoyloxy-propyl) octadecanoate

(2-methyl-2-nitro-3-octadecanoyloxy-propyl) octadecanoate

Systemtic Name:(2-methyl-2-nitro-3-octadecanoyloxy-propyl) octadecanoate
Openeye Name:(2-methyl-2-nitro-3-octadecanoyloxy-propyl) octadecanoate
CAS Name:octadecanoic acid [2-methyl-2-nitro-3-(1-oxooctadecoxy)propyl] ester
IUPAC Name:(2-methyl-2-nitro-3-octadecanoyloxypropyl) octadecanoate
Traditional Name:stearic acid (2-methyl-2-nitro-3-stearoyloxy-propyl) ester
Formula: C40H77NO6
MolecularWeight: 668.04248
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCCCCCCCCCC)[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCCCCCCCCCC)[N+](=O)[O-]


InChI

InChI=1S/C40H77NO6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38(42)46-36-40(3,41(44)45)37-47-39(43)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h4-37H2,1-3H3


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