methyl dodecanoate; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene

Systemtic Name: methyl dodecanoate; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Openeye Name: methyl dodecanoate; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: dodecanoic acid methyl ester; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: methyl dodecanoate; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: lauric acid methyl ester; 3-nitro-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC.C1=CC2=C(C=C1O2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)OC.C1=CC2=C(C=C1O2)[N+](=O)[O-]

InChI

InChI=1S/C13H26O2.C6H3NO3/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2;8-7(9)5-3-4-1-2-6(5)10-4/h3-12H2,1-2H3;1-3H